data_2mb7_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 2mb7 _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 33.8 ptt180 . . . . . 0 N--CA 1.49 1.561 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 12.6 mttp -85.26 169.89 13.35 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.25 -0.907 . . . . 0.0 109.539 179.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.547 ' NH1' ' OE2' ' A' ' 20' ' ' GLU . 61.8 ttt85 -155.87 95.04 1.6 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.207 -0.933 . . . . 0.0 109.441 -178.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 7.7 m0 -111.24 139.41 46.64 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.247 -0.908 . . . . 0.0 109.475 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -83.43 149.67 26.53 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.276 -0.89 . . . . 0.0 109.467 179.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 34.3 m -114.75 100.46 53.39 Favored Pre-proline 0 N--CA 1.491 1.587 0 O-C-N 121.203 -0.935 . . . . 0.0 109.492 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -55.56 -27.21 58.75 Favored 'Trans proline' 0 C--N 1.305 -1.748 0 C-N-CA 122.877 2.385 . . . . 0.0 112.272 178.3 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.41 -34.48 74.01 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.257 -0.902 . . . . 0.0 109.474 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.4 mt -90.15 157.46 45.37 Favored Pre-proline 0 N--CA 1.489 1.524 0 O-C-N 121.18 -0.95 . . . . 0.0 109.376 -179.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_exo -54.8 145.26 62.08 Favored 'Trans proline' 0 C--N 1.305 -1.723 0 C-N-CA 122.848 2.365 . . . . 0.0 112.185 179.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 94.4 mm-40 -49.57 127.85 16.38 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.323 -0.861 . . . . 0.0 109.463 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 123.88 -18.35 7.55 Favored Glycine 0 N--CA 1.49 2.24 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . 0.405 ' CD1' ' N ' ' A' ' 17' ' ' TRP . 21.1 m95 -93.0 150.74 20.33 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.259 -1.142 . . . . 0.0 109.468 179.14 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.509 ' N ' ' OE1' ' A' ' 18' ' ' GLU . 59.4 mp0 -144.42 160.91 40.28 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.227 -0.92 . . . . 0.0 109.463 -179.474 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.517 ' NH1' ' N ' ' A' ' 69' ' ' GLY . 33.6 ttt180 -121.2 156.88 31.45 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.221 -0.924 . . . . 0.0 109.42 179.286 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.547 ' OE2' ' NH1' ' A' ' 7' ' ' ARG . 95.9 mt-10 -147.23 142.59 27.39 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.221 -0.924 . . . . 0.0 109.524 -179.662 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 80.2 tt0 -115.18 133.85 55.67 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.277 -0.889 . . . . 0.0 109.456 179.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.6 t -129.09 123.29 21.67 Favored Pre-proline 0 N--CA 1.491 1.589 0 O-C-N 121.272 -0.893 . . . . 0.0 109.538 -178.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -77.04 129.86 10.85 Favored 'Trans proline' 0 C--N 1.306 -1.701 0 C-N-CA 122.868 2.379 . . . . 0.0 112.145 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 23.3 mmm180 . . . . . 0 N--CA 1.491 1.585 0 O-C-N 121.185 -0.947 . . . . 0.0 109.424 179.973 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 . . . . . 0 N--CA 1.491 1.575 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 84.7 mtm-85 -115.64 127.61 55.32 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.246 -0.909 . . . . 0.0 109.556 -179.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.451 ' OD1' ' N ' ' A' ' 35' ' ' VAL . 62.8 t0 -106.12 142.55 35.63 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.229 -0.919 . . . . 0.0 109.417 -179.902 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.451 ' N ' ' OD1' ' A' ' 34' ' ' ASP . 46.9 t -111.03 129.4 66.36 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.246 -0.909 . . . . 0.0 109.413 -179.592 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -116.69 145.37 43.49 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.255 -0.903 . . . . 0.0 109.514 179.118 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.627 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 60.2 m-85 -115.05 149.8 36.91 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.273 -0.892 . . . . 0.0 109.472 179.638 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 94.9 m-85 -127.76 140.39 52.09 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.246 -0.909 . . . . 0.0 109.518 179.397 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.47 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -97.91 178.35 1.36 Allowed Pre-proline 0 N--CA 1.489 1.509 0 O-C-N 121.242 -0.911 . . . . 0.0 109.504 179.452 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.47 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 35.6 Cg_exo -56.6 -29.31 78.66 Favored 'Trans proline' 0 C--N 1.305 -1.727 0 C-N-CA 122.826 2.351 . . . . 0.0 112.206 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 91.4 p -87.39 -0.92 57.5 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.164 -0.96 . . . . 0.0 109.485 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 83.53 22.2 56.71 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -74.8 126.06 30.12 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.262 -1.14 . . . . 0.0 109.454 179.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -94.33 121.55 35.97 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.275 -0.89 . . . . 0.0 109.542 179.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.636 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 1.2 p90 -141.36 149.83 41.65 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.214 -0.929 . . . . 0.0 109.506 -179.874 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.93 68.62 1.42 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.256 -0.903 . . . . 0.0 109.464 179.247 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 44.9 m -151.06 130.71 13.09 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.279 -0.888 . . . . 0.0 109.466 179.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.742 ' N ' ' HD2' ' A' ' 49' ' ' PRO . 20.3 tttt -60.73 -53.92 59.61 Favored Pre-proline 0 N--CA 1.49 1.54 0 O-C-N 121.288 -0.882 . . . . 0.0 109.457 -179.517 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.742 ' HD2' ' N ' ' A' ' 48' ' ' LYS . 10.9 Cg_endo -52.99 -38.53 80.02 Favored 'Trans proline' 0 C--N 1.304 -1.766 0 C-N-CA 122.853 2.369 . . . . 0.0 112.203 -179.521 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -64.66 -36.95 85.91 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.205 -0.934 . . . . 0.0 109.521 178.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 4.1 mt -64.75 -44.53 89.8 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.284 -0.885 . . . . 0.0 109.429 179.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.696 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -73.79 -45.57 50.78 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.213 -0.929 . . . . 0.0 109.485 -179.219 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -60.88 -44.52 96.97 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.265 -0.897 . . . . 0.0 109.489 -179.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 29.0 t80 -66.8 -54.17 25.38 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.312 -0.868 . . . . 0.0 109.492 -179.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 94.6 mt -91.84 10.58 28.02 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.224 -0.923 . . . . 0.0 109.479 -179.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . 0.696 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -49.61 -71.08 0.66 Allowed Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 -179.63 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -54.07 -44.06 73.25 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 109.568 -1.413 . . . . 0.0 109.568 -179.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.425 ' HG ' ' CG ' ' A' ' 59' ' ' MET . 95.8 p -59.36 -29.66 67.84 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.231 -1.158 . . . . 0.0 109.463 -179.666 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.494 ' O ' ' O ' ' A' ' 56' ' ' GLY . 0.0 OUTLIER 179.5 173.38 0.86 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.229 -0.919 . . . . 0.0 109.479 -179.856 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 90.6 m-20 -102.24 123.48 46.15 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.287 -0.883 . . . . 0.0 109.477 179.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 98.6 mt -116.88 13.69 15.03 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.236 -0.915 . . . . 0.0 109.483 -179.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 92.9 p -56.11 -33.9 65.55 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.27 -0.894 . . . . 0.0 109.475 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 21.5 p -92.88 19.77 7.32 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.218 -0.926 . . . . 0.0 109.519 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -88.57 135.6 33.41 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.204 -0.935 . . . . 0.0 109.445 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.518 ' O ' ' N ' ' A' ' 69' ' ' GLY . 51.8 t0 -87.38 111.56 21.22 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.192 -0.943 . . . . 0.0 109.481 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.627 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 74.6 t80 -75.91 -41.68 51.15 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.227 -0.92 . . . . 0.0 109.527 -179.323 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.405 ' HD2' ' N ' ' A' ' 67' ' ' ARG . 3.2 mpt_? -62.12 -39.51 92.78 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.199 -0.938 . . . . 0.0 109.494 -179.046 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' THR . . . . . 0.458 ' OG1' ' CG ' ' A' ' 65' ' ' ASP . 44.0 p -103.05 -13.41 16.85 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.309 -0.869 . . . . 0.0 109.471 -178.447 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . 0.518 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 62.79 42.37 99.69 Favored Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.4 ' H ' ' HB3' ' A' ' 65' ' ' ASP . 68.6 mttm -132.71 154.5 50.12 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.227 -1.161 . . . . 0.0 109.488 -179.775 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 57.0 ttm -91.61 125.13 36.23 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.291 -0.881 . . . . 0.0 109.514 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 8.6 tp . . . . . 0 N--CA 1.489 1.525 0 O-C-N 121.259 -0.901 . . . . 0.0 109.479 179.85 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 85.0 mtp180 . . . . . 0 N--CA 1.489 1.507 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.43 ' O ' ' HA ' ' A' ' 20' ' ' GLU . 0.5 OUTLIER -111.14 106.18 15.13 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.264 -0.897 . . . . 0.0 109.53 179.917 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 56.0 ttp180 -102.13 118.12 36.22 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.181 -0.95 . . . . 0.0 109.34 -179.466 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.559 ' CD1' ' N ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -124.99 144.56 50.32 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.221 -0.924 . . . . 0.0 109.429 179.603 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -57.43 141.27 47.97 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.207 -0.933 . . . . 0.0 109.443 -179.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.5 ' SG ' ' C ' ' A' ' 17' ' ' TRP . 0.8 OUTLIER -96.64 123.03 55.52 Favored Pre-proline 0 N--CA 1.491 1.588 0 O-C-N 121.254 -0.904 . . . . 0.0 109.51 179.72 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -73.75 -32.87 7.02 Favored 'Trans proline' 0 C--N 1.304 -1.771 0 C-N-CA 122.88 2.387 . . . . 0.0 112.249 -178.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.0 -38.02 85.26 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.337 -0.852 . . . . 0.0 109.516 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.578 ' CD1' ' N ' ' A' ' 13' ' ' LEU . 5.1 mp -84.01 156.59 63.8 Favored Pre-proline 0 N--CA 1.49 1.566 0 O-C-N 121.277 -0.889 . . . . 0.0 109.52 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -49.72 155.75 3.63 Favored 'Trans proline' 0 C--N 1.306 -1.699 0 C-N-CA 122.774 2.316 . . . . 0.0 112.284 179.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -56.29 123.73 15.61 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.19 -0.944 . . . . 0.0 109.468 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 123.26 -33.99 3.82 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 179.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . 0.5 ' C ' ' SG ' ' A' ' 10' ' ' CYS . 49.8 m95 -71.31 149.59 45.97 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.308 -1.113 . . . . 0.0 109.481 179.222 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 68.3 mt-10 -145.32 157.98 43.93 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.345 -0.847 . . . . 0.0 109.54 -178.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.426 ' NH1' ' O ' ' A' ' 68' ' ' THR . 21.1 ptt180 -141.59 145.62 35.28 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.3 -0.875 . . . . 0.0 109.432 179.046 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.43 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 19.2 pt-20 -130.39 143.3 50.68 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.226 -0.921 . . . . 0.0 109.584 -179.385 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -98.59 136.99 37.89 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.267 -0.896 . . . . 0.0 109.471 178.417 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 30.7 t -143.13 100.92 5.3 Favored Pre-proline 0 N--CA 1.49 1.575 0 O-C-N 121.23 -0.919 . . . . 0.0 109.529 -179.172 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_exo -56.69 136.51 76.58 Favored 'Trans proline' 0 C--N 1.305 -1.726 0 C-N-CA 122.872 2.382 . . . . 0.0 112.185 177.388 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 23.0 ptt180 . . . . . 0 N--CA 1.491 1.598 0 O-C-N 121.239 -0.913 . . . . 0.0 109.491 179.825 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 28.9 m170 . . . . . 0 N--CA 1.49 1.531 0 N-CA-C 109.468 -0.568 . . . . 0.0 109.468 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 50.5 ptt85 -118.35 137.53 53.03 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.351 -0.843 . . . . 0.0 109.465 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.409 ' OD1' ' N ' ' A' ' 35' ' ' VAL . 64.0 t0 -104.16 133.92 48.27 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.26 -0.9 . . . . 0.0 109.438 -179.495 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.409 ' N ' ' OD1' ' A' ' 34' ' ' ASP . 57.7 t -109.68 132.91 56.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 O-C-N 121.26 -0.9 . . . . 0.0 109.442 179.379 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -111.72 141.81 44.87 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.233 -0.917 . . . . 0.0 109.388 -179.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.541 ' CE1' ' CZ ' ' A' ' 66' ' ' PHE . 44.1 m-85 -114.81 143.25 45.38 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.25 -0.907 . . . . 0.0 109.475 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 87.8 m-85 -122.91 133.34 54.41 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.182 -0.949 . . . . 0.0 109.513 -179.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.472 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.4 OUTLIER -98.59 178.59 1.26 Allowed Pre-proline 0 N--CA 1.491 1.576 0 O-C-N 121.262 -0.899 . . . . 0.0 109.486 179.58 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.472 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 48.7 Cg_exo -54.6 -29.92 62.99 Favored 'Trans proline' 0 C--N 1.305 -1.752 0 C-N-CA 122.853 2.369 . . . . 0.0 112.206 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 96.4 p -85.89 7.82 22.65 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.272 -0.892 . . . . 0.0 109.485 179.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 72.71 8.59 72.76 Favored Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 -179.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 3.8 tmmt? -67.49 128.99 38.49 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.298 -1.119 . . . . 0.0 109.492 -179.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 51.9 pttt -99.14 130.34 45.45 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.262 -0.899 . . . . 0.0 109.451 179.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.491 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 9.8 p90 -141.69 149.19 40.24 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.306 -0.872 . . . . 0.0 109.479 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 25.7 ptt-85 -130.84 50.69 2.2 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.176 -0.952 . . . . 0.0 109.486 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -159.27 143.87 15.45 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.226 -0.921 . . . . 0.0 109.478 -179.888 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.633 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 10.6 tttt -60.14 -44.67 96.99 Favored Pre-proline 0 N--CA 1.489 1.501 0 O-C-N 121.205 -0.934 . . . . 0.0 109.515 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.633 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 47.3 Cg_exo -55.99 -38.69 94.33 Favored 'Trans proline' 0 C--N 1.305 -1.741 0 C-N-CA 122.855 2.37 . . . . 0.0 112.192 179.706 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 94.9 mm-40 -67.57 -37.97 83.4 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.259 -0.901 . . . . 0.0 109.482 179.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.46 ' CD1' ' CZ3' ' A' ' 17' ' ' TRP . 57.8 tp -61.04 -45.58 94.19 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.307 -0.871 . . . . 0.0 109.509 179.747 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.517 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -68.59 -40.37 80.51 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.241 -0.912 . . . . 0.0 109.392 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 77.7 ttt-85 -53.5 -44.65 69.25 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.328 -0.857 . . . . 0.0 109.478 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 50.5 t80 -66.31 -49.2 67.86 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.242 -0.911 . . . . 0.0 109.423 179.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.583 ' O ' ' N ' ' A' ' 57' ' ' GLY . 98.6 mt -80.75 4.87 17.5 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.25 -0.906 . . . . 0.0 109.454 179.753 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . 0.517 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . 60.11 -74.6 0.01 OUTLIER Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.561 -1.416 . . . . 0.0 109.561 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . 0.583 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . 177.28 37.66 0.06 OUTLIER Glycine 0 N--CA 1.49 2.241 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 -179.712 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 87.1 p -93.34 8.32 40.91 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.23 -1.159 . . . . 0.0 109.45 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 99.7 mtp -145.87 139.83 26.59 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.23 -0.918 . . . . 0.0 109.5 -179.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.404 ' OD1' ' N ' ' A' ' 60' ' ' ASP . 38.4 p-10 -80.53 96.02 6.67 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.103 -0.998 . . . . 0.0 109.494 179.572 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 90.1 mt -95.41 -1.83 50.19 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.286 -0.884 . . . . 0.0 109.48 -179.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 35.8 t -53.96 -29.83 44.37 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.182 -0.949 . . . . 0.0 109.505 179.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 69.4 p -106.91 18.49 21.75 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.302 -0.874 . . . . 0.0 109.527 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.437 ' O ' ' CE ' ' A' ' 48' ' ' LYS . 14.8 t80 -88.22 124.73 34.14 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.215 -0.928 . . . . 0.0 109.51 -179.746 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.415 ' O ' ' N ' ' A' ' 69' ' ' GLY . 7.8 m-20 -79.92 113.57 18.18 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.302 -0.874 . . . . 0.0 109.451 -179.535 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.541 ' CZ ' ' CE1' ' A' ' 37' ' ' TYR . 58.5 t80 -79.24 -42.21 26.45 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.293 -0.879 . . . . 0.0 109.442 -179.791 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 83.7 mmt-85 -62.86 -40.17 96.67 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.199 -0.938 . . . . 0.0 109.453 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' THR . . . . . 0.426 ' O ' ' NH1' ' A' ' 19' ' ' ARG . 27.6 p -97.78 -13.62 21.26 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.335 -0.853 . . . . 0.0 109.472 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . 0.415 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 61.62 40.41 98.71 Favored Glycine 0 N--CA 1.489 2.204 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 -179.844 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -128.67 149.7 50.56 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.172 -1.193 . . . . 0.0 109.437 -179.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 36.6 ttm -94.12 112.86 24.71 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.267 -0.896 . . . . 0.0 109.397 179.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.533 0 O-C-N 121.287 -0.883 . . . . 0.0 109.41 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.4 tpt180 . . . . . 0 N--CA 1.491 1.578 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 31.1 mttt -79.4 169.69 17.7 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.291 -0.88 . . . . 0.0 109.462 -179.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.574 ' O ' ' CD1' ' A' ' 8' ' ' TRP . 79.0 mtp85 -143.66 135.12 26.08 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.324 -0.86 . . . . 0.0 109.455 -178.701 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.574 ' CD1' ' O ' ' A' ' 7' ' ' ARG . 6.3 m0 -157.85 129.09 6.63 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.207 -0.933 . . . . 0.0 109.438 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 45.8 tt0 -86.9 121.58 29.58 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.149 -0.97 . . . . 0.0 109.556 178.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.455 ' CA ' HH12 ' A' ' 19' ' ' ARG . 0.0 OUTLIER -79.61 123.85 83.97 Favored Pre-proline 0 N--CA 1.49 1.532 0 O-C-N 121.316 -0.865 . . . . 0.0 109.479 -179.444 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -71.8 -13.53 29.46 Favored 'Trans proline' 0 C--N 1.305 -1.721 0 C-N-CA 122.797 2.331 . . . . 0.0 112.235 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.452 ' O ' ' SD ' ' A' ' 59' ' ' MET . . . -82.64 -14.72 54.22 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.279 -0.888 . . . . 0.0 109.531 179.76 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.536 ' CD1' ' N ' ' A' ' 13' ' ' LEU . 5.8 mp -100.38 156.07 35.66 Favored Pre-proline 0 N--CA 1.49 1.571 0 O-C-N 121.161 -0.962 . . . . 0.0 109.428 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -57.1 142.09 94.27 Favored 'Trans proline' 0 C--N 1.305 -1.741 0 C-N-CA 122.911 2.407 . . . . 0.0 112.202 178.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -47.77 128.82 13.6 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.323 -0.86 . . . . 0.0 109.411 179.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 117.83 -17.79 11.82 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 -179.617 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 24.3 m95 -92.09 151.77 20.26 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.365 -1.079 . . . . 0.0 109.458 179.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -151.05 164.8 35.59 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.252 -0.905 . . . . 0.0 109.502 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.455 HH12 ' CA ' ' A' ' 10' ' ' CYS . 35.9 ptt-85 -142.7 149.13 38.41 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.29 -0.881 . . . . 0.0 109.509 179.331 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -124.51 162.94 22.93 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.26 -0.9 . . . . 0.0 109.509 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -117.54 135.66 53.79 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.302 -0.874 . . . . 0.0 109.388 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.4 t -131.32 115.2 16.15 Favored Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.261 -0.899 . . . . 0.0 109.546 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -76.58 142.02 22.81 Favored 'Trans proline' 0 C--N 1.304 -1.786 0 C-N-CA 122.91 2.407 . . . . 0.0 112.13 -179.262 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 23.0 mmt180 . . . . . 0 N--CA 1.49 1.546 0 O-C-N 121.247 -0.908 . . . . 0.0 109.579 179.734 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 31.6 m170 . . . . . 0 N--CA 1.489 1.522 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -108.78 111.94 23.96 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.316 -0.865 . . . . 0.0 109.495 -179.601 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 87.3 m-20 -84.69 139.3 32.11 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.285 -0.884 . . . . 0.0 109.433 179.086 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 42.6 t -113.82 128.74 70.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.298 -0.876 . . . . 0.0 109.453 -179.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.408 ' CE2' ' HD3' ' A' ' 46' ' ' ARG . 67.2 m-85 -105.62 142.81 34.71 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.324 -0.86 . . . . 0.0 109.437 179.608 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.552 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 68.4 m-85 -109.66 144.5 37.93 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.285 -0.884 . . . . 0.0 109.44 -179.406 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 -128.22 141.81 51.35 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.246 -0.909 . . . . 0.0 109.543 -179.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.461 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.4 OUTLIER -99.95 177.04 1.66 Allowed Pre-proline 0 N--CA 1.489 1.52 0 O-C-N 121.254 -0.904 . . . . 0.0 109.506 179.485 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.461 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 47.1 Cg_exo -55.45 -35.43 92.1 Favored 'Trans proline' 0 C--N 1.306 -1.704 0 C-N-CA 122.77 2.313 . . . . 0.0 112.31 -178.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 68.1 m -80.35 -4.4 53.31 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.206 -0.934 . . . . 0.0 109.482 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 89.42 16.0 57.78 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 179.722 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -66.75 122.15 17.02 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.262 -1.14 . . . . 0.0 109.471 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.403 ' CE ' ' CD2' ' A' ' 36' ' ' PHE . 87.4 tttt -93.99 123.03 37.09 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.267 -0.896 . . . . 0.0 109.472 179.306 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.609 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 1.6 p90 -140.92 148.37 40.32 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.335 -0.853 . . . . 0.0 109.418 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.408 ' HD3' ' CE2' ' A' ' 36' ' ' PHE . 65.7 ttp85 -134.07 65.46 1.57 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.184 -0.947 . . . . 0.0 109.508 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.9 m -150.12 130.28 13.6 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.231 -0.918 . . . . 0.0 109.452 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.726 ' N ' ' HD2' ' A' ' 49' ' ' PRO . 24.1 tttt -62.8 -54.08 50.43 Favored Pre-proline 0 N--CA 1.49 1.53 0 O-C-N 121.279 -0.888 . . . . 0.0 109.489 -179.857 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.726 ' HD2' ' N ' ' A' ' 48' ' ' LYS . 18.9 Cg_endo -57.65 -38.66 92.65 Favored 'Trans proline' 0 C--N 1.306 -1.692 0 C-N-CA 122.792 2.328 . . . . 0.0 112.198 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -65.39 -39.73 92.57 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.28 -0.887 . . . . 0.0 109.5 179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 5.1 tt -69.29 -41.15 77.2 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.26 -0.9 . . . . 0.0 109.536 179.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.576 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -62.62 -43.02 99.86 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.185 -0.947 . . . . 0.0 109.472 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.462 HH12 ' HB2' ' A' ' 49' ' ' PRO . 92.6 mtm-85 -59.45 -42.51 92.14 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.306 -0.871 . . . . 0.0 109.479 179.492 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -59.78 -50.23 74.63 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.396 -0.815 . . . . 0.0 109.508 179.127 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.423 ' N ' HD21 ' A' ' 55' ' ' LEU . 3.6 mm? -85.78 -0.13 54.43 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.186 -0.946 . . . . 0.0 109.491 178.383 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . 0.576 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -61.87 97.6 0.16 Allowed Glycine 0 N--CA 1.492 2.367 0 N-CA-C 109.506 -1.438 . . . . 0.0 109.506 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 132.26 -63.98 0.62 Allowed Glycine 0 N--CA 1.489 2.226 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 76.2 p -69.88 -24.75 63.46 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.182 -1.187 . . . . 0.0 109.574 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.452 ' SD ' ' O ' ' A' ' 12' ' ' ALA . 55.1 ttm -159.3 149.5 19.13 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.229 -0.92 . . . . 0.0 109.475 -179.717 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 49.8 t0 -95.16 117.04 29.54 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.235 -0.916 . . . . 0.0 109.45 179.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 10.7 mp -113.44 10.23 18.24 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.336 -0.853 . . . . 0.0 109.433 -179.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 50.3 m -52.44 -37.28 56.54 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.234 -0.916 . . . . 0.0 109.463 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 17.9 p -92.62 18.83 8.11 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.188 -0.945 . . . . 0.0 109.485 179.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.41 ' CD1' ' CB ' ' A' ' 12' ' ' ALA . 70.0 t80 -90.99 132.58 35.9 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.19 -0.944 . . . . 0.0 109.387 179.628 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.503 ' O ' ' N ' ' A' ' 69' ' ' GLY . 60.7 t0 -82.63 112.65 19.71 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.205 -0.935 . . . . 0.0 109.563 179.911 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.552 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 73.7 t80 -75.17 -44.3 47.43 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.207 -0.933 . . . . 0.0 109.417 -179.23 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 13.7 tpt180 -58.06 -44.5 87.49 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.263 -0.898 . . . . 0.0 109.423 -179.118 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' THR . . . . . 0.452 ' OG1' ' CG ' ' A' ' 65' ' ' ASP . 49.7 p -97.13 -12.94 22.49 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.292 -0.88 . . . . 0.0 109.468 -179.288 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . 0.503 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 61.65 40.86 99.32 Favored Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -130.77 156.24 45.3 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.314 -1.109 . . . . 0.0 109.453 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 5.4 ttm -94.98 120.43 35.18 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.267 -0.895 . . . . 0.0 109.492 179.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.442 ' C ' ' CD1' ' A' ' 72' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.573 0 O-C-N 121.269 -0.894 . . . . 0.0 109.424 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.405 ' N ' ' HD2' ' A' ' 5' ' ' ARG . 11.7 mpt_? . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.58 96.84 7.63 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.263 -0.898 . . . . 0.0 109.529 -179.6 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.444 ' O ' ' CG ' ' A' ' 8' ' ' TRP . 99.3 mtt180 -71.81 167.59 19.65 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.254 -0.904 . . . . 0.0 109.5 179.604 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.444 ' CG ' ' O ' ' A' ' 7' ' ' ARG . 0.8 OUTLIER -166.21 144.66 5.66 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.17 -0.956 . . . . 0.0 109.514 -179.716 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.465 ' OE1' ' N ' ' A' ' 9' ' ' GLU . 58.7 mp0 -92.56 137.05 32.7 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.25 -0.906 . . . . 0.0 109.454 179.73 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.539 ' SG ' ' O ' ' A' ' 69' ' ' GLY . 0.5 OUTLIER -115.11 101.44 54.49 Favored Pre-proline 0 N--CA 1.49 1.529 0 O-C-N 121.301 -0.874 . . . . 0.0 109.567 -179.831 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -51.3 -37.79 60.83 Favored 'Trans proline' 0 C--N 1.306 -1.683 0 C-N-CA 122.872 2.381 . . . . 0.0 112.208 179.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.94 -24.3 64.25 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.213 -0.929 . . . . 0.0 109.511 179.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 7.2 mp -87.41 157.13 53.43 Favored Pre-proline 0 N--CA 1.49 1.554 0 O-C-N 121.324 -0.86 . . . . 0.0 109.542 179.491 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . 0.451 ' HG2' ' CD1' ' A' ' 17' ' ' TRP . 18.0 Cg_endo -59.8 140.76 94.79 Favored 'Trans proline' 0 C--N 1.305 -1.742 0 C-N-CA 122.802 2.334 . . . . 0.0 112.172 -179.694 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -53.18 121.49 7.61 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.279 -0.888 . . . . 0.0 109.524 -179.175 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 122.6 -27.48 5.98 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 179.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . 0.456 ' CZ3' ' CZ ' ' A' ' 45' ' ' PHE . 11.5 m95 -83.69 154.45 23.65 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.343 -1.093 . . . . 0.0 109.553 179.728 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -143.68 157.94 44.03 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.325 -0.86 . . . . 0.0 109.455 -179.436 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.57 ' NH1' ' O ' ' A' ' 69' ' ' GLY . 33.8 ptt180 -124.42 163.56 21.53 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.244 -0.91 . . . . 0.0 109.485 179.777 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -141.8 140.92 33.13 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.284 -0.885 . . . . 0.0 109.571 -179.172 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 28.5 tp10 -101.89 122.36 43.86 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.317 -0.865 . . . . 0.0 109.438 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.5 t -118.25 98.47 51.41 Favored Pre-proline 0 N--CA 1.49 1.529 0 O-C-N 121.17 -0.956 . . . . 0.0 109.639 -179.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -58.58 128.04 26.8 Favored 'Trans proline' 0 C--N 1.305 -1.712 0 C-N-CA 122.851 2.367 . . . . 0.0 112.184 179.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.414 ' NE ' ' HB2' ' A' ' 34' ' ' ASP . 99.5 mtt180 . . . . . 0 N--CA 1.49 1.529 0 O-C-N 121.148 -0.97 . . . . 0.0 109.462 178.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 73.6 m80 . . . . . 0 N--CA 1.491 1.577 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 94.9 mtt-85 -110.59 121.51 45.5 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.26 -0.9 . . . . 0.0 109.518 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.414 ' HB2' ' NE ' ' A' ' 24' ' ' ARG . 58.6 t0 -84.38 136.68 33.78 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.318 -0.864 . . . . 0.0 109.474 179.32 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 25.0 t -111.06 128.16 67.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.267 -0.896 . . . . 0.0 109.502 -179.128 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 52.9 m-85 -117.44 147.15 42.97 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.245 -0.909 . . . . 0.0 109.499 179.098 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 -117.8 148.96 41.58 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.195 -0.941 . . . . 0.0 109.363 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.425 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 12.9 m-85 -133.21 144.59 49.9 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.216 -0.928 . . . . 0.0 109.579 -178.759 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.44 ' H ' ' HG ' ' A' ' 39' ' ' SER . 4.6 p -103.38 159.44 29.28 Favored Pre-proline 0 N--CA 1.491 1.584 0 O-C-N 121.24 -0.913 . . . . 0.0 109.474 179.051 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -54.01 -16.36 9.01 Favored 'Trans proline' 0 C--N 1.304 -1.779 0 C-N-CA 122.788 2.325 . . . . 0.0 112.271 178.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 4.5 m -86.15 -2.16 58.09 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.242 -0.911 . . . . 0.0 109.526 179.081 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 84.83 5.83 85.94 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 41.6 tttp -75.67 119.61 19.93 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.255 -1.144 . . . . 0.0 109.38 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -93.53 121.98 35.49 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.221 -0.924 . . . . 0.0 109.487 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.456 ' CZ ' ' CZ3' ' A' ' 17' ' ' TRP . 2.7 p90 -141.0 149.69 42.09 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.252 -0.905 . . . . 0.0 109.437 178.865 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.696 ' O ' ' C ' ' A' ' 47' ' ' SER . 70.8 ttp85 -124.58 -72.54 0.67 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.321 -0.862 . . . . 0.0 109.463 179.815 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.696 ' C ' ' O ' ' A' ' 46' ' ' ARG . 0.7 OUTLIER -21.26 130.41 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.321 -0.862 . . . . 0.0 109.503 179.664 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.656 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 4.8 tttm -65.74 -42.79 57.01 Favored Pre-proline 0 N--CA 1.491 1.584 0 O-C-N 121.171 -0.956 . . . . 0.0 109.498 179.866 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.656 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 49.8 Cg_exo -54.77 -49.62 16.12 Favored 'Trans proline' 0 C--N 1.306 -1.704 0 C-N-CA 122.831 2.354 . . . . 0.0 112.253 -179.521 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.417 ' CG ' ' N ' ' A' ' 51' ' ' LEU . 0.6 OUTLIER -68.01 -33.78 75.25 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.282 -0.886 . . . . 0.0 109.546 179.765 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.417 ' N ' ' CG ' ' A' ' 50' ' ' GLN . 6.9 tt -62.55 -43.88 97.73 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.281 -0.887 . . . . 0.0 109.46 179.68 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -69.84 -40.21 75.95 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.238 -0.914 . . . . 0.0 109.503 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 70.8 ttp85 -58.44 -44.15 89.04 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.291 -0.881 . . . . 0.0 109.535 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 42.8 t80 -59.54 -50.68 72.98 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.228 -0.92 . . . . 0.0 109.545 179.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 80.1 mt -58.12 -43.15 87.05 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.158 -0.964 . . . . 0.0 109.47 179.278 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . 0.412 ' O ' ' C ' ' A' ' 57' ' ' GLY . . . 65.35 83.07 0.1 OUTLIER Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 179.086 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . 0.412 ' C ' ' O ' ' A' ' 56' ' ' GLY . . . 44.08 72.95 0.28 Allowed Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.515 -1.434 . . . . 0.0 109.515 179.058 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 6.9 m -119.5 -26.7 5.71 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.256 -1.144 . . . . 0.0 109.509 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -169.34 160.0 9.12 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.29 -0.881 . . . . 0.0 109.506 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 50.5 t0 -80.6 92.36 5.94 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.345 -0.847 . . . . 0.0 109.5 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 96.0 mt -100.98 -0.56 36.35 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.279 -0.888 . . . . 0.0 109.402 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 5.0 t -54.4 -30.84 53.49 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.268 -0.895 . . . . 0.0 109.522 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 76.0 p -92.27 11.49 25.63 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.225 -0.922 . . . . 0.0 109.437 179.723 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.41 ' CZ ' ' C ' ' A' ' 69' ' ' GLY . 74.3 t80 -86.89 131.78 34.01 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.27 -0.894 . . . . 0.0 109.519 -179.74 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.518 ' O ' ' N ' ' A' ' 69' ' ' GLY . 55.8 t0 -82.94 114.82 21.48 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.266 -0.896 . . . . 0.0 109.478 -179.629 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 24.2 t80 -75.18 -47.42 28.45 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.179 -0.95 . . . . 0.0 109.523 -179.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 7.7 mmt85 -55.22 -42.33 73.23 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.133 -0.98 . . . . 0.0 109.478 -179.002 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' THR . . . . . 0.404 ' OG1' ' CG ' ' A' ' 65' ' ' ASP . 33.2 p -98.69 -13.97 20.02 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.223 -0.923 . . . . 0.0 109.53 -179.455 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . 0.57 ' O ' ' NH1' ' A' ' 19' ' ' ARG . . . 61.07 40.85 99.1 Favored Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 179.777 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -134.8 153.77 51.89 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.297 -1.12 . . . . 0.0 109.492 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 12.8 ttm -87.41 126.28 34.78 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.271 -0.893 . . . . 0.0 109.479 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 97.0 mt . . . . . 0 N--CA 1.489 1.506 0 O-C-N 121.239 -0.913 . . . . 0.0 109.501 179.899 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 61.0 ttp180 . . . . . 0 N--CA 1.49 1.534 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.4 mptt -120.9 113.96 20.87 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.25 -0.906 . . . . 0.0 109.447 179.766 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.448 ' CZ ' ' OE2' ' A' ' 18' ' ' GLU . 14.8 ttp180 -96.36 118.05 32.11 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.285 -0.884 . . . . 0.0 109.468 -179.548 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 5.1 m0 -106.43 156.26 18.72 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.3 -0.875 . . . . 0.0 109.502 179.464 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 84.9 tt0 -72.45 148.73 44.86 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.3 -0.875 . . . . 0.0 109.51 -179.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.592 ' SG ' ' CZ ' ' A' ' 19' ' ' ARG . 74.8 m -106.69 104.83 52.86 Favored Pre-proline 0 N--CA 1.49 1.559 0 O-C-N 121.244 -0.91 . . . . 0.0 109.473 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -76.56 -21.19 13.24 Favored 'Trans proline' 0 C--N 1.306 -1.671 0 C-N-CA 122.78 2.32 . . . . 0.0 112.241 -179.565 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -84.24 -34.91 23.76 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.225 -0.922 . . . . 0.0 109.498 179.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.618 ' CD1' ' N ' ' A' ' 13' ' ' LEU . 4.6 mp -82.6 156.48 68.13 Favored Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.215 -0.928 . . . . 0.0 109.435 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -51.64 140.26 46.24 Favored 'Trans proline' 0 C--N 1.305 -1.722 0 C-N-CA 122.827 2.352 . . . . 0.0 112.192 179.352 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.556 ' H ' ' NE2' ' A' ' 15' ' ' GLN . 4.0 mp0 -45.85 122.85 4.01 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.27 -0.894 . . . . 0.0 109.448 -179.836 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 123.25 -18.86 7.77 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.59 -1.404 . . . . 0.0 109.59 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 26.5 m95 -92.65 151.18 20.24 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.176 -1.191 . . . . 0.0 109.499 179.405 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.448 ' OE2' ' CZ ' ' A' ' 7' ' ' ARG . 71.3 mt-10 -148.89 162.51 39.71 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.181 -0.949 . . . . 0.0 109.487 -179.399 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.592 ' CZ ' ' SG ' ' A' ' 10' ' ' CYS . 10.9 ptp85 -140.04 146.11 38.57 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.298 -0.876 . . . . 0.0 109.492 179.58 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -139.13 146.71 40.98 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.203 -0.935 . . . . 0.0 109.471 -178.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -103.1 140.14 37.7 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.311 -0.868 . . . . 0.0 109.47 178.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.0 t -141.6 123.48 9.12 Favored Pre-proline 0 N--CA 1.491 1.598 0 O-C-N 121.227 -0.921 . . . . 0.0 109.584 -179.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -75.4 135.41 18.33 Favored 'Trans proline' 0 C--N 1.304 -1.767 0 C-N-CA 122.863 2.375 . . . . 0.0 112.153 178.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 18.6 ttm180 . . . . . 0 N--CA 1.489 1.519 0 O-C-N 121.176 -0.953 . . . . 0.0 109.527 -179.927 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 73.9 m80 . . . . . 0 N--CA 1.488 1.443 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 17.2 ptp180 -117.7 134.59 54.74 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.214 -0.929 . . . . 0.0 109.486 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -105.2 141.88 35.95 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.281 -0.887 . . . . 0.0 109.45 -179.057 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 43.6 t -109.76 135.71 47.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.236 -0.915 . . . . 0.0 109.414 179.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 55.3 m-85 -121.96 144.18 49.03 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.17 -0.956 . . . . 0.0 109.49 -179.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.582 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 54.6 m-85 -115.68 147.89 40.34 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.284 -0.885 . . . . 0.0 109.475 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 36.4 m-85 -127.25 141.04 51.82 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.297 -0.877 . . . . 0.0 109.456 -179.524 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.634 ' HG ' ' N ' ' A' ' 40' ' ' PRO . 0.4 OUTLIER -98.86 177.64 1.52 Allowed Pre-proline 0 N--CA 1.49 1.553 0 O-C-N 121.375 -0.828 . . . . 0.0 109.397 179.448 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.634 ' N ' ' HG ' ' A' ' 39' ' ' SER . 53.0 Cg_exo -54.36 -34.67 81.57 Favored 'Trans proline' 0 C--N 1.305 -1.726 0 C-N-CA 122.861 2.374 . . . . 0.0 112.322 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.439 ' H ' ' HG ' ' A' ' 39' ' ' SER . 46.6 t -85.8 1.16 50.8 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.298 -0.876 . . . . 0.0 109.468 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 85.41 15.86 65.5 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 81.9 tttt -66.52 121.54 15.57 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.189 -1.183 . . . . 0.0 109.514 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 62.4 tttm -92.77 124.85 37.07 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.206 -0.933 . . . . 0.0 109.506 179.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.553 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 2.3 p90 -139.88 146.12 38.89 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.264 -0.898 . . . . 0.0 109.455 -179.721 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 14.9 ptm180 -136.64 59.57 1.69 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.233 -0.917 . . . . 0.0 109.493 179.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.528 ' HG ' ' H ' ' A' ' 50' ' ' GLN . 3.7 p -153.35 137.65 16.6 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.324 -0.86 . . . . 0.0 109.476 179.563 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.607 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 0.9 OUTLIER -66.52 -46.23 58.34 Favored Pre-proline 0 N--CA 1.489 1.499 0 O-C-N 121.314 -0.866 . . . . 0.0 109.503 -179.298 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.607 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 44.3 Cg_exo -55.83 -48.88 17.71 Favored 'Trans proline' 0 C--N 1.305 -1.738 0 C-N-CA 122.855 2.37 . . . . 0.0 112.261 -178.817 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.528 ' H ' ' HG ' ' A' ' 47' ' ' SER . 17.6 tt0 -65.76 -37.42 86.29 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.229 -0.919 . . . . 0.0 109.502 -179.833 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 44.5 tp -65.75 -47.57 74.78 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.286 -0.883 . . . . 0.0 109.553 -179.31 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.648 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -67.01 -45.55 77.23 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.324 -0.86 . . . . 0.0 109.51 -179.58 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 62.6 ttp180 -60.68 -45.54 93.75 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.173 -0.954 . . . . 0.0 109.514 -179.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 25.5 t80 -63.08 -52.57 62.2 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.301 -0.874 . . . . 0.0 109.479 -179.066 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 98.0 mt -88.7 3.98 48.87 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.21 -0.931 . . . . 0.0 109.447 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . 0.648 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -61.89 -39.66 97.81 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.49 -1.444 . . . . 0.0 109.49 -179.621 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -83.23 2.35 87.19 Favored Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.51 -1.436 . . . . 0.0 109.51 -179.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 79.3 p -119.13 -23.31 6.86 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.326 -1.103 . . . . 0.0 109.457 -179.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 8.3 ttm -176.49 168.99 2.68 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.29 -0.881 . . . . 0.0 109.459 -179.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 93.5 m-20 -96.39 114.57 26.26 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.226 -0.921 . . . . 0.0 109.5 179.382 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.56 ' CD2' ' N ' ' A' ' 61' ' ' LEU . 3.6 mm? -98.31 4.69 48.68 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.231 -0.918 . . . . 0.0 109.49 -179.404 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 77.5 p -58.03 -38.26 75.9 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.252 -0.905 . . . . 0.0 109.46 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 19.6 p -87.56 6.21 35.5 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.269 -0.894 . . . . 0.0 109.463 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.41 ' CZ ' ' HA2' ' A' ' 69' ' ' GLY . 55.6 t80 -91.88 122.88 34.82 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.22 -0.925 . . . . 0.0 109.448 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.451 ' O ' ' N ' ' A' ' 69' ' ' GLY . 97.5 m-20 -75.35 114.38 13.82 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.25 -0.906 . . . . 0.0 109.493 179.805 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.582 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 81.9 t80 -77.76 -41.03 38.98 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.227 -0.921 . . . . 0.0 109.497 -179.378 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -61.56 -45.12 95.5 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.198 -0.939 . . . . 0.0 109.459 -179.801 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 46.0 p -95.06 -15.53 23.37 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.229 -0.919 . . . . 0.0 109.499 -179.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . 0.451 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 63.92 44.64 95.75 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.57 -1.412 . . . . 0.0 109.57 -179.683 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 64.8 mttp -142.22 158.27 43.92 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.224 -1.163 . . . . 0.0 109.444 -179.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 1.2 mmt -79.69 136.81 36.88 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.232 -0.917 . . . . 0.0 109.435 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 48.9 tp . . . . . 0 N--CA 1.489 1.496 0 O-C-N 121.177 -0.952 . . . . 0.0 109.499 -179.712 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 95.3 mtt-85 . . . . . 0 N--CA 1.49 1.564 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 73.6 mttt -72.98 153.7 40.83 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.288 -0.883 . . . . 0.0 109.445 179.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.584 ' O ' ' CD1' ' A' ' 8' ' ' TRP . 51.4 ptt85 -149.37 140.88 23.36 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.181 -0.949 . . . . 0.0 109.506 -179.309 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.584 ' CD1' ' O ' ' A' ' 7' ' ' ARG . 7.0 m0 -147.95 129.16 14.67 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.264 -0.897 . . . . 0.0 109.513 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -99.63 127.36 45.73 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.306 -0.871 . . . . 0.0 109.458 179.523 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.414 ' HB3' ' HE ' ' A' ' 19' ' ' ARG . 4.7 t -103.47 134.79 19.56 Favored Pre-proline 0 N--CA 1.491 1.619 0 O-C-N 121.277 -0.89 . . . . 0.0 109.414 -179.629 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -69.54 -14.07 36.22 Favored 'Trans proline' 0 C--N 1.306 -1.696 0 C-N-CA 122.861 2.374 . . . . 0.0 112.194 -179.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.39 -34.68 74.88 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.174 -0.954 . . . . 0.0 109.462 179.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.639 ' N ' ' CD2' ' A' ' 13' ' ' LEU . 2.6 mm? -91.02 150.47 41.84 Favored Pre-proline 0 N--CA 1.489 1.523 0 O-C-N 121.18 -0.95 . . . . 0.0 109.437 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -63.94 156.98 55.2 Favored 'Trans proline' 0 C--N 1.305 -1.725 0 C-N-CA 122.748 2.298 . . . . 0.0 112.219 -179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 55.7 tt0 -53.29 128.02 26.72 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.227 -0.921 . . . . 0.0 109.451 -179.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 124.82 -23.64 6.21 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.589 -1.404 . . . . 0.0 109.589 179.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . 0.448 ' CH2' ' CD2' ' A' ' 55' ' ' LEU . 49.9 m95 -87.64 143.66 27.07 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.294 -1.121 . . . . 0.0 109.406 179.708 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -143.55 156.7 44.68 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.27 -0.894 . . . . 0.0 109.515 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.531 ' NH2' ' CD2' ' A' ' 13' ' ' LEU . 53.0 mtt-85 -129.38 129.44 44.75 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.292 -0.88 . . . . 0.0 109.447 179.038 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -134.04 140.43 46.66 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.273 -0.892 . . . . 0.0 109.515 -179.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -104.57 149.05 25.84 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.246 -0.909 . . . . 0.0 109.428 178.595 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 4.7 t -145.84 124.76 6.61 Favored Pre-proline 0 N--CA 1.491 1.625 0 O-C-N 121.209 -0.932 . . . . 0.0 109.598 -179.43 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -75.32 136.47 19.8 Favored 'Trans proline' 0 C--N 1.304 -1.784 0 C-N-CA 122.849 2.366 . . . . 0.0 112.133 179.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 6.4 tpt180 . . . . . 0 N--CA 1.491 1.575 0 O-C-N 121.248 -0.907 . . . . 0.0 109.496 179.767 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 80.4 m80 . . . . . 0 N--CA 1.492 1.627 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 88.0 mtm-85 -118.94 136.68 53.95 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.175 -0.953 . . . . 0.0 109.492 179.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 93.4 m-20 -116.61 141.31 48.36 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.278 -0.889 . . . . 0.0 109.444 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.6 t -105.19 132.79 51.16 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.26 -0.9 . . . . 0.0 109.435 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -120.76 143.3 48.88 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.223 -0.923 . . . . 0.0 109.51 179.621 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 50.6 m-85 -118.63 146.64 44.5 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.209 -0.932 . . . . 0.0 109.437 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -127.71 138.36 52.77 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.241 -0.912 . . . . 0.0 109.552 -179.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.498 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.4 OUTLIER -99.85 179.32 1.06 Allowed Pre-proline 0 N--CA 1.49 1.545 0 O-C-N 121.194 -0.941 . . . . 0.0 109.504 179.147 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.498 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 40.2 Cg_exo -56.43 -32.59 89.54 Favored 'Trans proline' 0 C--N 1.305 -1.76 0 C-N-CA 122.81 2.34 . . . . 0.0 112.289 -179.628 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 7.4 m -87.08 5.13 39.16 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.369 -0.832 . . . . 0.0 109.594 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 81.43 10.07 85.03 Favored Glycine 0 N--CA 1.49 2.234 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 64.9 tttp -62.89 119.43 9.37 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.238 -1.154 . . . . 0.0 109.492 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.97 123.33 39.52 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.217 -0.927 . . . . 0.0 109.429 179.045 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 41.8 p90 -141.02 147.05 38.05 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.239 -0.913 . . . . 0.0 109.493 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 44.7 ptt85 -130.6 56.05 1.79 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.253 -0.904 . . . . 0.0 109.51 179.499 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -159.33 146.77 17.19 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.193 -0.942 . . . . 0.0 109.522 -179.84 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.655 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 0.5 OUTLIER -68.87 -42.87 25.38 Favored Pre-proline 0 N--CA 1.49 1.562 0 O-C-N 121.207 -0.933 . . . . 0.0 109.504 -179.581 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.655 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 51.0 Cg_exo -55.01 -44.63 47.81 Favored 'Trans proline' 0 C--N 1.306 -1.686 0 C-N-CA 122.761 2.307 . . . . 0.0 112.231 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 18.2 mm100 -71.32 -37.0 71.79 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.229 -0.919 . . . . 0.0 109.445 179.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.4 ' C ' ' CD2' ' A' ' 51' ' ' LEU . 3.8 tt -63.44 -47.36 82.21 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.263 -0.898 . . . . 0.0 109.502 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -66.15 -41.91 89.74 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.182 -0.949 . . . . 0.0 109.497 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 77.7 ttt-85 -56.45 -45.39 80.86 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.223 -0.923 . . . . 0.0 109.511 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -66.24 -50.0 65.27 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.325 -0.86 . . . . 0.0 109.455 179.284 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.448 ' CD2' ' CH2' ' A' ' 17' ' ' TRP . 4.2 mm? -70.9 -3.32 18.62 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.199 -0.938 . . . . 0.0 109.415 179.704 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . 0.711 ' O ' ' N ' ' A' ' 58' ' ' SER . . . -50.87 161.68 1.28 Allowed Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.534 -1.426 . . . . 0.0 109.534 179.771 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 59.38 -61.04 0.01 OUTLIER Glycine 0 N--CA 1.489 2.226 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 -179.529 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.711 ' N ' ' O ' ' A' ' 56' ' ' GLY . 80.7 p -60.88 -28.96 69.27 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.273 -1.133 . . . . 0.0 109.463 -178.761 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.429 ' CB ' ' O ' ' A' ' 58' ' ' SER . 2.8 mtp 169.45 126.88 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.219 -0.926 . . . . 0.0 109.452 -179.479 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.621 ' OD1' ' N ' ' A' ' 61' ' ' LEU . 62.0 t0 -70.62 151.74 44.66 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.313 -0.867 . . . . 0.0 109.424 179.312 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.621 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 3.7 mp -133.19 24.87 4.2 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.273 -0.892 . . . . 0.0 109.494 -179.04 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 58.0 m -52.61 -32.68 42.85 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.148 -0.97 . . . . 0.0 109.484 -179.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' THR . . . . . 0.509 ' O ' ' SD ' ' A' ' 71' ' ' MET . 19.8 p -94.71 35.14 1.26 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.227 -0.92 . . . . 0.0 109.481 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 93.1 t80 -99.05 129.06 45.3 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.259 -0.901 . . . . 0.0 109.455 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 91.7 m-20 -81.9 114.29 20.41 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.253 -0.904 . . . . 0.0 109.375 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -76.45 -41.13 48.47 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.305 -0.872 . . . . 0.0 109.476 -179.549 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 23.1 mmm180 -63.24 -36.34 83.35 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.312 -0.868 . . . . 0.0 109.444 -178.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 19.5 p -95.53 -16.04 22.45 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.299 -0.875 . . . . 0.0 109.476 -179.414 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 64.64 36.48 93.19 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.571 -1.412 . . . . 0.0 109.571 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.8 mtmp? -145.87 162.52 37.54 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.355 -1.085 . . . . 0.0 109.439 -179.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.509 ' SD ' ' O ' ' A' ' 63' ' ' THR . 9.6 tpp -80.84 128.33 33.54 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.235 -0.916 . . . . 0.0 109.534 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 3.5 tt . . . . . 0 N--CA 1.491 1.605 0 O-C-N 121.336 -0.852 . . . . 0.0 109.472 -179.763 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 84.5 mtp180 . . . . . 0 N--CA 1.491 1.594 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 26.3 mmtp -109.49 101.0 9.99 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.234 -0.916 . . . . 0.0 109.495 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 41.1 ttm180 -98.35 118.69 35.56 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.225 -0.922 . . . . 0.0 109.392 -179.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.555 ' CD1' ' N ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -132.53 152.03 51.71 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.239 -0.913 . . . . 0.0 109.503 179.284 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 79.3 tt0 -90.91 141.78 28.46 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.301 -0.874 . . . . 0.0 109.473 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.539 ' SG ' ' O ' ' A' ' 69' ' ' GLY . 0.8 OUTLIER -108.25 159.49 30.48 Favored Pre-proline 0 N--CA 1.49 1.533 0 O-C-N 121.336 -0.853 . . . . 0.0 109.454 179.841 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -65.05 -20.62 63.72 Favored 'Trans proline' 0 C--N 1.304 -1.764 0 C-N-CA 122.855 2.37 . . . . 0.0 112.237 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -93.29 -4.92 50.88 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.165 -0.959 . . . . 0.0 109.473 179.723 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 8.7 mp -98.95 113.41 64.54 Favored Pre-proline 0 N--CA 1.491 1.601 0 O-C-N 121.184 -0.948 . . . . 0.0 109.46 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -50.75 155.51 5.5 Favored 'Trans proline' 0 C--N 1.306 -1.707 0 C-N-CA 122.756 2.304 . . . . 0.0 112.261 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -49.93 106.8 0.13 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.305 -0.872 . . . . 0.0 109.523 179.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 125.89 -25.23 5.59 Favored Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.621 -1.392 . . . . 0.0 109.621 179.171 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 47.6 m95 -92.86 139.7 30.27 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.302 -1.116 . . . . 0.0 109.467 178.385 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -151.73 166.19 32.07 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.211 -0.93 . . . . 0.0 109.501 -178.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.511 ' NH1' ' OH ' ' A' ' 37' ' ' TYR . 12.1 ptm180 -140.92 145.86 36.64 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.27 -0.894 . . . . 0.0 109.384 178.887 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -132.92 145.98 51.39 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.239 -0.913 . . . . 0.0 109.462 -179.117 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 79.7 tt0 -100.01 136.67 39.55 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.271 -0.893 . . . . 0.0 109.452 178.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.5 t -135.4 133.71 20.67 Favored Pre-proline 0 N--CA 1.49 1.566 0 O-C-N 121.158 -0.964 . . . . 0.0 109.584 -178.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -50.11 150.86 9.75 Favored 'Trans proline' 0 C--N 1.304 -1.779 0 C-N-CA 122.821 2.347 . . . . 0.0 112.099 178.296 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.639 0 O-C-N 121.201 -0.937 . . . . 0.0 109.44 -179.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 56.8 m80 . . . . . 0 N--CA 1.491 1.592 0 CA-C-O 121.341 0.591 . . . . 0.0 109.493 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -116.8 134.77 54.38 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.14 -0.975 . . . . 0.0 109.492 179.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.597 ' OD2' ' CE2' ' A' ' 36' ' ' PHE . 9.2 t70 -103.12 140.73 36.94 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.202 -0.936 . . . . 0.0 109.481 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.592 ' O ' ' CD ' ' A' ' 46' ' ' ARG . 97.6 t -119.67 132.12 70.3 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.251 -0.905 . . . . 0.0 109.481 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.597 ' CE2' ' OD2' ' A' ' 34' ' ' ASP . 94.5 m-85 -116.2 150.89 36.76 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.221 -0.925 . . . . 0.0 109.542 -179.674 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.596 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 23.2 m-85 -112.69 147.15 37.39 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.257 -0.902 . . . . 0.0 109.463 179.737 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -126.39 139.44 53.27 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.214 -0.929 . . . . 0.0 109.552 -179.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.67 ' HG ' ' N ' ' A' ' 40' ' ' PRO . 0.2 OUTLIER -102.23 174.57 2.78 Favored Pre-proline 0 N--CA 1.489 1.51 0 O-C-N 121.251 -0.906 . . . . 0.0 109.419 179.33 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.67 ' N ' ' HG ' ' A' ' 39' ' ' SER . 52.8 Cg_exo -52.79 -35.95 71.59 Favored 'Trans proline' 0 C--N 1.306 -1.699 0 C-N-CA 122.85 2.367 . . . . 0.0 112.225 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 4.2 m -82.48 -1.01 49.02 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.342 -0.848 . . . . 0.0 109.476 -179.639 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 87.15 11.93 68.82 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -70.04 116.14 10.06 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.259 -1.142 . . . . 0.0 109.494 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 20.0 pttp -94.92 132.59 39.58 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.13 -0.981 . . . . 0.0 109.5 178.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.443 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 8.5 p90 -141.68 151.8 43.32 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.324 -0.86 . . . . 0.0 109.49 -179.776 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.592 ' CD ' ' O ' ' A' ' 35' ' ' VAL . 24.1 tpt85 -125.26 63.39 1.17 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.175 -0.953 . . . . 0.0 109.494 179.29 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.0 t -150.84 125.66 9.74 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.24 -0.913 . . . . 0.0 109.42 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.729 ' N ' ' HD2' ' A' ' 49' ' ' PRO . 20.1 tttt -65.21 -53.47 40.04 Favored Pre-proline 0 N--CA 1.489 1.48 0 O-C-N 121.233 -0.917 . . . . 0.0 109.506 -179.598 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.729 ' HD2' ' N ' ' A' ' 48' ' ' LYS . 14.5 Cg_endo -56.56 -38.69 94.95 Favored 'Trans proline' 0 C--N 1.304 -1.765 0 C-N-CA 122.877 2.385 . . . . 0.0 112.148 179.19 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -65.5 -35.22 80.23 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.344 -0.848 . . . . 0.0 109.432 179.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.4 ' C ' ' CD2' ' A' ' 51' ' ' LEU . 4.4 tt -68.54 -42.54 78.28 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.277 -0.89 . . . . 0.0 109.491 179.647 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.591 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -62.55 -41.28 98.8 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.268 -0.895 . . . . 0.0 109.463 -179.813 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 71.7 ttp85 -59.5 -48.66 80.79 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.175 -0.953 . . . . 0.0 109.457 179.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 6.2 t80 -63.79 -49.08 74.33 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.268 -0.895 . . . . 0.0 109.524 179.431 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.437 ' O ' ' O ' ' A' ' 59' ' ' MET . 3.3 mm? -81.34 -0.72 42.42 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.161 -0.962 . . . . 0.0 109.451 179.672 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . 0.591 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -62.07 -35.15 91.05 Favored Glycine 0 N--CA 1.489 2.218 0 N-CA-C 109.604 -1.399 . . . . 0.0 109.604 -179.584 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -88.64 -3.12 78.02 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.459 -1.456 . . . . 0.0 109.459 -179.32 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -112.34 -30.7 7.08 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.308 -1.113 . . . . 0.0 109.494 -179.574 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.437 ' O ' ' O ' ' A' ' 55' ' ' LEU . 31.2 ttp -174.58 167.25 3.86 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.286 -0.884 . . . . 0.0 109.471 -179.771 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 93.7 m-20 -92.52 113.36 25.61 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.196 -0.94 . . . . 0.0 109.518 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 11.1 mp -111.61 9.54 21.11 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.246 -0.909 . . . . 0.0 109.505 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.44 ' HG ' ' N ' ' A' ' 63' ' ' THR . 88.5 p -55.78 -34.8 65.59 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.286 -0.884 . . . . 0.0 109.541 -179.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' THR . . . . . 0.44 ' N ' ' HG ' ' A' ' 62' ' ' SER . 10.4 p -91.83 24.86 2.98 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.281 -0.887 . . . . 0.0 109.445 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -91.41 126.18 36.41 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.103 -0.998 . . . . 0.0 109.438 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.552 ' O ' ' N ' ' A' ' 69' ' ' GLY . 96.5 m-20 -75.84 111.77 11.54 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.211 -0.93 . . . . 0.0 109.513 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.596 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 66.1 t80 -74.29 -45.01 50.36 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.236 -0.915 . . . . 0.0 109.49 -179.385 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 24.6 mmm180 -63.88 -37.9 89.11 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.2 -0.938 . . . . 0.0 109.471 -178.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' THR . . . . . 0.402 ' OG1' ' CB ' ' A' ' 65' ' ' ASP . 5.6 p -98.9 -15.26 19.24 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.297 -0.877 . . . . 0.0 109.538 -179.376 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . 0.552 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 62.3 39.11 97.3 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.634 -1.386 . . . . 0.0 109.634 -179.842 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -133.42 151.59 51.82 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.216 -1.167 . . . . 0.0 109.413 -179.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 6.6 ttm -96.01 124.44 40.02 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.201 -0.937 . . . . 0.0 109.381 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 58.0 tp . . . . . 0 N--CA 1.491 1.614 0 O-C-N 121.274 -0.891 . . . . 0.0 109.428 -179.709 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 89.7 mtm180 . . . . . 0 N--CA 1.49 1.567 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.425 ' CE ' ' OE1' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -72.06 154.86 40.87 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.326 -0.859 . . . . 0.0 109.49 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 62.7 ttp180 -153.3 144.62 23.14 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.229 -0.92 . . . . 0.0 109.388 -179.495 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.627 ' CD1' ' N ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -166.1 139.48 4.18 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.15 -0.969 . . . . 0.0 109.536 -179.331 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -105.8 117.68 34.65 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.179 -0.951 . . . . 0.0 109.472 178.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.638 ' N ' HH12 ' A' ' 19' ' ' ARG . 10.1 p -92.37 137.45 24.64 Favored Pre-proline 0 N--CA 1.491 1.608 0 O-C-N 121.319 -0.863 . . . . 0.0 109.416 -178.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -69.89 -16.69 37.09 Favored 'Trans proline' 0 C--N 1.304 -1.794 0 C-N-CA 122.783 2.322 . . . . 0.0 112.262 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.22 -31.76 70.47 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.297 -0.877 . . . . 0.0 109.484 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.57 ' CD2' ' N ' ' A' ' 13' ' ' LEU . 3.7 mm? -95.39 154.44 39.37 Favored Pre-proline 0 N--CA 1.491 1.604 0 O-C-N 121.346 -0.846 . . . . 0.0 109.477 179.825 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -55.42 144.13 74.19 Favored 'Trans proline' 0 C--N 1.306 -1.704 0 C-N-CA 122.798 2.332 . . . . 0.0 112.165 179.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -49.18 129.15 17.72 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.268 -0.895 . . . . 0.0 109.485 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 118.04 -19.89 10.86 Favored Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.594 -1.403 . . . . 0.0 109.594 -179.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 20.7 m95 -85.09 144.09 28.45 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.232 -1.158 . . . . 0.0 109.45 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -144.63 157.06 44.37 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.253 -0.904 . . . . 0.0 109.477 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.638 HH12 ' N ' ' A' ' 10' ' ' CYS . 32.8 ptt-85 -147.25 152.54 38.48 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.179 -0.951 . . . . 0.0 109.381 179.502 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.401 ' O ' ' CD ' ' A' ' 20' ' ' GLU . 0.0 OUTLIER -150.61 151.0 31.89 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.28 -0.888 . . . . 0.0 109.526 -179.499 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.425 ' OE1' ' CE ' ' A' ' 6' ' ' LYS . 86.4 tt0 -96.57 146.06 25.16 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.268 -0.895 . . . . 0.0 109.326 179.184 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.8 t -144.43 122.79 6.82 Favored Pre-proline 0 N--CA 1.49 1.554 0 O-C-N 121.245 -0.909 . . . . 0.0 109.523 -178.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -75.76 136.51 18.99 Favored 'Trans proline' 0 C--N 1.306 -1.693 0 C-N-CA 122.828 2.352 . . . . 0.0 112.214 179.451 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 95.1 mtt-85 . . . . . 0 N--CA 1.488 1.469 0 O-C-N 121.18 -0.95 . . . . 0.0 109.534 -179.676 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 37.7 m80 . . . . . 0 N--CA 1.489 1.52 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.39 139.49 52.73 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.234 -0.916 . . . . 0.0 109.385 -179.837 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.564 ' OD1' ' N ' ' A' ' 35' ' ' VAL . 67.3 t0 -119.37 142.01 48.54 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.269 -0.894 . . . . 0.0 109.455 -179.711 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.564 ' N ' ' OD1' ' A' ' 34' ' ' ASP . 62.7 t -110.58 140.82 27.99 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.246 -0.909 . . . . 0.0 109.397 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 65.0 m-85 -122.52 149.98 43.19 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.245 -0.91 . . . . 0.0 109.498 -179.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.562 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 22.3 m-85 -116.58 145.22 43.53 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.289 -0.882 . . . . 0.0 109.408 -179.884 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -120.5 134.87 55.22 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.209 -0.932 . . . . 0.0 109.445 -179.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.503 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -97.6 -179.56 0.9 Allowed Pre-proline 0 N--CA 1.491 1.586 0 O-C-N 121.301 -0.875 . . . . 0.0 109.358 179.221 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.503 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 39.2 Cg_exo -56.86 -28.97 79.69 Favored 'Trans proline' 0 C--N 1.306 -1.671 0 C-N-CA 122.836 2.357 . . . . 0.0 112.151 -179.633 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 94.1 p -91.44 2.48 56.38 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.261 -0.899 . . . . 0.0 109.518 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 83.45 14.78 72.95 Favored Glycine 0 N--CA 1.49 2.243 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -70.91 123.98 23.28 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.293 -1.122 . . . . 0.0 109.404 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.66 ' NZ ' HH22 ' A' ' 46' ' ' ARG . 18.6 pttp -95.32 129.6 42.4 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.216 -0.927 . . . . 0.0 109.48 179.202 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.659 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 0.7 OUTLIER -140.52 147.85 40.16 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.316 -0.865 . . . . 0.0 109.431 -179.837 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.66 HH22 ' NZ ' ' A' ' 44' ' ' LYS . 6.2 ptp85 -134.06 57.43 1.81 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.288 -0.882 . . . . 0.0 109.466 179.664 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -150.73 132.48 14.97 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.217 -0.927 . . . . 0.0 109.524 -179.78 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.722 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 2.7 tmtm? -71.25 -39.37 7.9 Favored Pre-proline 0 N--CA 1.491 1.593 0 O-C-N 121.319 -0.863 . . . . 0.0 109.488 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.722 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 33.0 Cg_exo -57.6 -55.17 2.61 Favored 'Trans proline' 0 C--N 1.306 -1.699 0 C-N-CA 122.894 2.396 . . . . 0.0 112.181 -179.556 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 26.7 tt0 -69.34 -31.83 70.53 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.274 -0.891 . . . . 0.0 109.474 179.437 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.503 ' C ' ' CD2' ' A' ' 51' ' ' LEU . 6.6 tt -67.78 -51.79 44.78 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.271 -0.893 . . . . 0.0 109.525 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.678 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -65.11 -42.74 93.7 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.163 -0.96 . . . . 0.0 109.511 179.885 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 80.3 mmt-85 -62.48 -37.89 87.71 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.269 -0.894 . . . . 0.0 109.521 -179.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 33.2 t80 -59.75 -51.66 68.8 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.313 -0.867 . . . . 0.0 109.445 -179.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.471 ' C ' ' H ' ' A' ' 57' ' ' GLY . 79.0 mt -100.3 5.63 44.54 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.24 -0.913 . . . . 0.0 109.517 179.683 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . 0.678 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -52.72 -10.94 1.11 Allowed Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 -179.202 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . 0.471 ' H ' ' C ' ' A' ' 55' ' ' LEU . . . -106.22 -50.12 0.89 Allowed Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.556 -1.417 . . . . 0.0 109.556 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 95.1 p -63.64 -24.25 67.71 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.288 -1.125 . . . . 0.0 109.531 -179.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 2.1 mmm -169.77 163.42 9.83 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.23 -0.919 . . . . 0.0 109.405 -179.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 49.7 t0 -95.37 114.89 26.71 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.222 -0.924 . . . . 0.0 109.465 179.636 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 95.2 mt -110.61 7.05 22.25 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.227 -0.921 . . . . 0.0 109.467 -179.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 33.4 t -51.93 -32.05 31.38 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.2 -0.938 . . . . 0.0 109.437 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 24.2 p -91.99 14.31 16.15 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.238 -0.914 . . . . 0.0 109.452 -179.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.536 ' O ' ' NZ ' ' A' ' 48' ' ' LYS . 84.0 t80 -89.7 123.56 33.83 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.248 -0.908 . . . . 0.0 109.44 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 82.4 m-20 -78.59 124.19 27.9 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.325 -0.86 . . . . 0.0 109.448 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.562 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 77.5 t80 -77.45 -43.18 33.28 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.293 -0.879 . . . . 0.0 109.486 179.445 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.22 -45.39 94.77 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.286 -0.884 . . . . 0.0 109.459 -178.923 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 76.0 p -92.49 -17.85 23.96 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.274 -0.891 . . . . 0.0 109.5 -179.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 62.85 28.59 72.07 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.504 -1.438 . . . . 0.0 109.504 -179.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 64.4 mttp -125.25 153.49 43.11 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.324 -1.103 . . . . 0.0 109.44 -179.436 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 24.7 ttm -90.65 126.43 35.97 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.272 -0.893 . . . . 0.0 109.514 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 1.6 tt . . . . . 0 N--CA 1.489 1.517 0 O-C-N 121.171 -0.956 . . . . 0.0 109.527 179.75 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.449 ' NE ' ' OE2' ' A' ' 20' ' ' GLU . 79.3 mtp180 . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 121.352 0.596 . . . . 0.0 109.421 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.44 ' HB3' ' CH2' ' A' ' 8' ' ' TRP . 59.8 mttt -82.9 168.83 16.69 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.183 -0.948 . . . . 0.0 109.472 -179.303 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.432 ' HG2' ' O ' ' A' ' 6' ' ' LYS . 22.7 mmt180 -146.57 138.01 24.45 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.154 -0.967 . . . . 0.0 109.455 -178.179 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.481 ' HE1' ' HB2' ' A' ' 21' ' ' GLU . 12.4 m95 -123.61 118.16 26.68 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.228 -0.92 . . . . 0.0 109.489 179.088 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 -78.41 148.83 33.47 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.22 -0.925 . . . . 0.0 109.518 178.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.536 ' SG ' ' NE ' ' A' ' 19' ' ' ARG . 20.8 p -135.13 101.5 11.29 Favored Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.155 -0.966 . . . . 0.0 109.494 -179.278 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -73.54 -11.44 24.36 Favored 'Trans proline' 0 C--N 1.305 -1.761 0 C-N-CA 122.836 2.358 . . . . 0.0 112.224 179.227 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -80.21 -21.14 43.23 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.221 -0.924 . . . . 0.0 109.409 178.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.565 ' CD2' ' N ' ' A' ' 13' ' ' LEU . 3.3 mm? -98.94 156.78 35.13 Favored Pre-proline 0 N--CA 1.489 1.499 0 O-C-N 121.198 -0.939 . . . . 0.0 109.43 179.544 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -52.79 147.51 31.68 Favored 'Trans proline' 0 C--N 1.305 -1.736 0 C-N-CA 122.838 2.359 . . . . 0.0 112.263 178.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 27.3 mm100 -56.64 125.47 22.39 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.232 -0.917 . . . . 0.0 109.507 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 124.54 -18.9 7.18 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.57 -1.412 . . . . 0.0 109.57 179.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 47.9 m95 -91.21 137.35 32.43 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.237 -1.154 . . . . 0.0 109.441 179.319 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -146.58 162.35 38.57 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.236 -0.915 . . . . 0.0 109.485 -179.151 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.536 ' NE ' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -123.04 160.24 26.73 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.274 -0.892 . . . . 0.0 109.473 178.812 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.449 ' OE2' ' NE ' ' A' ' 5' ' ' ARG . 75.6 tt0 -145.11 134.82 23.45 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.29 -0.881 . . . . 0.0 109.464 -179.082 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.481 ' HB2' ' HE1' ' A' ' 8' ' ' TRP . 4.0 tp10 -103.95 129.97 51.54 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.21 -0.931 . . . . 0.0 109.35 178.191 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.0 t -134.12 99.21 13.68 Favored Pre-proline 0 N--CA 1.489 1.476 0 O-C-N 121.271 -0.893 . . . . 0.0 109.593 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -58.03 135.19 67.08 Favored 'Trans proline' 0 C--N 1.304 -1.796 0 C-N-CA 122.858 2.372 . . . . 0.0 112.122 178.105 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.43 HH11 ' HD2' ' A' ' 24' ' ' ARG . 20.8 ttm105 . . . . . 0 N--CA 1.489 1.505 0 O-C-N 121.231 -0.918 . . . . 0.0 109.464 179.619 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 71.0 m80 . . . . . 0 N--CA 1.489 1.522 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 37.2 ptt-85 -117.26 138.86 51.45 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.343 -0.848 . . . . 0.0 109.481 179.759 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -100.68 138.45 37.72 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.243 -0.911 . . . . 0.0 109.452 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 37.6 t -110.04 134.62 51.6 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.304 -0.872 . . . . 0.0 109.437 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -119.55 145.06 46.7 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.289 -0.882 . . . . 0.0 109.478 179.586 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.689 ' CE1' ' CZ ' ' A' ' 66' ' ' PHE . 7.7 m-85 -114.84 145.27 42.34 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.267 -0.895 . . . . 0.0 109.4 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -123.68 135.52 53.94 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.34 -0.85 . . . . 0.0 109.608 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.457 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -98.21 177.96 1.46 Allowed Pre-proline 0 N--CA 1.49 1.533 0 O-C-N 121.28 -0.888 . . . . 0.0 109.467 179.325 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.457 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 50.0 Cg_exo -55.08 -32.95 81.83 Favored 'Trans proline' 0 C--N 1.305 -1.731 0 C-N-CA 122.82 2.347 . . . . 0.0 112.339 179.862 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 41.1 t -87.52 4.35 43.87 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.341 -0.849 . . . . 0.0 109.494 -179.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 82.09 16.15 72.86 Favored Glycine 0 N--CA 1.489 2.175 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 -179.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -70.25 119.62 14.71 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.29 -1.123 . . . . 0.0 109.509 179.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.428 ' O ' ' CG ' ' A' ' 44' ' ' LYS . 24.3 pttm -94.8 125.03 39.19 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.235 -0.916 . . . . 0.0 109.494 178.873 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 31.8 p90 -141.48 149.04 40.4 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.214 -0.929 . . . . 0.0 109.557 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 26.5 ptt-85 -133.91 60.78 1.69 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.178 -0.951 . . . . 0.0 109.439 179.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.2 m -155.62 138.83 15.63 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.243 -0.911 . . . . 0.0 109.469 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.606 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 2.3 tttm -65.9 -45.8 64.65 Favored Pre-proline 0 N--CA 1.49 1.536 0 O-C-N 121.245 -0.909 . . . . 0.0 109.41 -179.719 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.606 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 49.0 Cg_exo -54.97 -44.4 50.13 Favored 'Trans proline' 0 C--N 1.306 -1.679 0 C-N-CA 122.84 2.36 . . . . 0.0 112.228 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -67.78 -38.15 83.0 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.236 -0.915 . . . . 0.0 109.444 179.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 55.3 tp -65.87 -45.8 80.77 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.31 -0.869 . . . . 0.0 109.397 -179.329 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.707 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -69.02 -44.56 72.48 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.302 -0.874 . . . . 0.0 109.529 -179.648 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 7.9 tpt180 -60.22 -43.3 96.13 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.267 -0.896 . . . . 0.0 109.456 -179.474 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 25.9 t80 -62.64 -52.86 61.68 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.181 -0.95 . . . . 0.0 109.451 -179.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.403 ' O ' ' C ' ' A' ' 56' ' ' GLY . 97.6 mt -90.9 2.53 56.12 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.271 -0.893 . . . . 0.0 109.464 179.78 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . 0.707 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -45.06 -78.13 0.08 OUTLIER Glycine 0 N--CA 1.491 2.359 0 N-CA-C 109.471 -1.452 . . . . 0.0 109.471 -179.913 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.32 7.47 0.22 Allowed Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 -179.564 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.601 ' H ' ' C ' ' A' ' 56' ' ' GLY . 3.0 m -104.19 -27.03 12.29 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.228 -1.16 . . . . 0.0 109.533 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 1.7 ptp 178.1 171.25 0.7 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.253 -0.905 . . . . 0.0 109.48 -179.463 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 59.6 t0 -93.56 111.44 23.11 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.194 -0.942 . . . . 0.0 109.397 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 10.7 mp -99.73 5.1 45.71 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.239 -0.913 . . . . 0.0 109.428 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 23.4 m -46.16 -38.78 8.68 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.279 -0.888 . . . . 0.0 109.462 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 55.8 p -95.35 49.65 1.21 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.301 -0.874 . . . . 0.0 109.4 179.315 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 65.9 t80 -116.61 132.16 56.76 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.302 -0.874 . . . . 0.0 109.477 -179.576 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 91.8 m-20 -93.42 107.75 19.53 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.188 -0.945 . . . . 0.0 109.544 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.689 ' CZ ' ' CE1' ' A' ' 37' ' ' TYR . 53.2 t80 -75.43 -40.36 57.78 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.339 -0.851 . . . . 0.0 109.465 -179.723 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 27.9 mmt180 -62.05 -32.89 73.45 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.282 -0.886 . . . . 0.0 109.464 -179.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 16.1 p -95.22 -15.23 23.4 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.258 -0.901 . . . . 0.0 109.486 -179.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 67.12 27.02 73.34 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.579 -1.408 . . . . 0.0 109.579 -179.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -138.19 158.0 45.17 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.198 -1.178 . . . . 0.0 109.47 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.427 ' O ' ' C ' ' A' ' 72' ' ' LEU . 19.9 ttm -91.35 132.76 35.97 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.192 -0.942 . . . . 0.0 109.543 -179.763 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.427 ' C ' ' O ' ' A' ' 71' ' ' MET . 56.1 tp . . . . . 0 N--CA 1.49 1.567 0 O-C-N 121.281 -0.887 . . . . 0.0 109.528 -179.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 84.0 mtt85 . . . . . 0 N--CA 1.49 1.568 0 CA-C-O 121.317 0.58 . . . . 0.0 109.512 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 26.1 mmtp -100.32 98.04 8.74 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.159 -0.963 . . . . 0.0 109.532 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.586 HH21 ' CD ' ' A' ' 18' ' ' GLU . 85.2 mtp180 -70.66 166.2 21.28 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.173 -0.954 . . . . 0.0 109.465 -179.405 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.491 ' CG ' ' O ' ' A' ' 7' ' ' ARG . 1.3 m0 -165.8 141.9 5.15 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.235 -0.916 . . . . 0.0 109.542 -179.474 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -111.29 139.59 46.56 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.247 -0.908 . . . . 0.0 109.493 179.256 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.7 t -127.58 140.6 38.49 Favored Pre-proline 0 N--CA 1.49 1.567 0 O-C-N 121.247 -0.908 . . . . 0.0 109.505 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -51.11 -31.79 37.05 Favored 'Trans proline' 0 C--N 1.305 -1.756 0 C-N-CA 122.812 2.342 . . . . 0.0 112.157 179.333 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -76.89 -10.73 59.57 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.164 -0.96 . . . . 0.0 109.462 -179.492 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.6 mp -90.43 116.17 65.79 Favored Pre-proline 0 N--CA 1.49 1.567 0 O-C-N 121.243 -0.911 . . . . 0.0 109.495 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . 0.415 ' O ' ' C ' ' A' ' 15' ' ' GLN . 48.6 Cg_exo -51.04 141.93 35.98 Favored 'Trans proline' 0 C--N 1.305 -1.725 0 C-N-CA 122.832 2.355 . . . . 0.0 112.244 -179.551 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.415 ' C ' ' O ' ' A' ' 14' ' ' PRO . 0.0 OUTLIER -44.64 107.17 0.09 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.249 -0.907 . . . . 0.0 109.523 -179.498 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 127.13 -23.87 5.45 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 178.725 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 24.1 m95 -80.04 139.13 37.07 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.215 -1.168 . . . . 0.0 109.46 178.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.586 ' CD ' HH21 ' A' ' 7' ' ' ARG . 97.0 mt-10 -127.95 150.47 49.88 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.248 -0.908 . . . . 0.0 109.432 -178.089 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.402 ' NH1' ' HA3' ' A' ' 69' ' ' GLY . 53.8 ttp180 -128.16 149.89 50.24 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.219 -0.926 . . . . 0.0 109.493 177.807 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 18.8 pt-20 -156.07 141.02 17.25 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.288 -0.883 . . . . 0.0 109.496 -179.226 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 79.6 tt0 -98.49 133.04 43.41 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.229 -0.919 . . . . 0.0 109.352 178.458 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.6 t -139.78 103.46 6.95 Favored Pre-proline 0 N--CA 1.49 1.559 0 O-C-N 121.182 -0.948 . . . . 0.0 109.533 -178.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . 0.448 ' HA ' ' HA ' ' A' ' 33' ' ' ARG . 47.1 Cg_exo -55.38 129.34 34.67 Favored 'Trans proline' 0 C--N 1.305 -1.715 0 C-N-CA 122.881 2.387 . . . . 0.0 112.203 178.685 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 . . . . . 0 N--CA 1.49 1.572 0 O-C-N 121.203 -0.936 . . . . 0.0 109.476 179.716 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 52.8 m-70 . . . . . 0 N--CA 1.489 1.521 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.448 ' HA ' ' HA ' ' A' ' 23' ' ' PRO . 99.6 mtt180 -53.67 132.39 40.76 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.229 -0.919 . . . . 0.0 109.458 179.555 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.607 ' OD1' ' N ' ' A' ' 35' ' ' VAL . 66.8 t0 -125.64 149.37 48.48 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.34 -0.85 . . . . 0.0 109.433 179.493 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.607 ' N ' ' OD1' ' A' ' 34' ' ' ASP . 64.0 t -117.06 133.75 62.82 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 O-C-N 121.247 -0.908 . . . . 0.0 109.469 -179.113 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.406 ' CZ ' ' OD2' ' A' ' 34' ' ' ASP . 96.7 m-85 -122.56 146.05 47.77 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.287 -0.883 . . . . 0.0 109.468 179.19 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.437 ' HB2' ' CE2' ' A' ' 45' ' ' PHE . 41.5 m-85 -116.07 151.34 35.74 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.262 -0.899 . . . . 0.0 109.501 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 67.5 m-85 -126.07 136.77 53.32 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.324 -0.86 . . . . 0.0 109.508 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.654 ' HG ' ' N ' ' A' ' 40' ' ' PRO . 0.4 OUTLIER -98.05 178.98 1.17 Allowed Pre-proline 0 N--CA 1.49 1.547 0 O-C-N 121.285 -0.884 . . . . 0.0 109.433 179.695 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.654 ' N ' ' HG ' ' A' ' 39' ' ' SER . 43.0 Cg_exo -55.67 -30.21 74.35 Favored 'Trans proline' 0 C--N 1.304 -1.802 0 C-N-CA 122.779 2.32 . . . . 0.0 112.212 -179.831 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.49 ' H ' ' HG ' ' A' ' 39' ' ' SER . 99.8 p -87.37 4.07 44.52 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.225 -0.922 . . . . 0.0 109.488 -179.567 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 77.61 17.09 79.43 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.557 -1.417 . . . . 0.0 109.557 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.25 125.52 29.58 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.276 -1.132 . . . . 0.0 109.493 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 24.8 pttm -92.29 135.52 33.95 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.3 -0.875 . . . . 0.0 109.475 179.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.588 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 1.3 p90 -140.34 146.92 39.09 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.262 -0.899 . . . . 0.0 109.416 179.714 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 19.0 ttm180 -131.56 59.36 1.7 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.241 -0.912 . . . . 0.0 109.548 179.296 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -160.92 141.65 11.47 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.234 -0.916 . . . . 0.0 109.421 -179.725 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.735 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 16.9 tptm -69.92 -37.92 8.5 Favored Pre-proline 0 N--CA 1.49 1.574 0 O-C-N 121.291 -0.881 . . . . 0.0 109.474 -179.291 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.735 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 33.6 Cg_exo -61.21 -51.24 4.68 Favored 'Trans proline' 0 C--N 1.305 -1.728 0 C-N-CA 122.866 2.378 . . . . 0.0 112.224 179.554 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -64.77 -34.9 79.42 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.257 -0.902 . . . . 0.0 109.463 179.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 5.6 tt -62.44 -48.36 80.0 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.242 -0.911 . . . . 0.0 109.405 -179.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -69.91 -42.62 73.11 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.267 -0.896 . . . . 0.0 109.438 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 61.5 ttp180 -59.05 -41.37 87.76 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.389 -0.819 . . . . 0.0 109.539 179.453 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 50.4 t80 -60.0 -54.49 45.4 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.218 -0.926 . . . . 0.0 109.454 -179.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.488 ' O ' ' OG ' ' A' ' 58' ' ' SER . 36.3 mt -63.62 -42.07 98.22 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.199 -0.938 . . . . 0.0 109.473 179.821 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 72.73 -139.76 27.97 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -84.86 -0.1 89.11 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.488 ' OG ' ' O ' ' A' ' 55' ' ' LEU . 78.0 p -66.43 -32.84 74.47 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.216 -1.167 . . . . 0.0 109.429 -179.744 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 44.4 mmm -144.42 135.78 25.5 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.213 -0.929 . . . . 0.0 109.469 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.461 ' O ' ' OD1' ' A' ' 60' ' ' ASP . 39.7 p-10 -93.13 112.3 24.2 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.231 -0.918 . . . . 0.0 109.551 179.326 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 9.7 mp -117.67 14.14 14.36 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.153 -0.967 . . . . 0.0 109.507 -179.246 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 83.3 p -49.38 -34.82 17.09 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.201 -0.937 . . . . 0.0 109.49 179.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 40.3 p -100.33 36.06 1.96 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.234 -0.916 . . . . 0.0 109.435 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.515 ' O ' ' NZ ' ' A' ' 48' ' ' LYS . 80.2 t80 -105.71 129.14 53.99 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.274 -0.891 . . . . 0.0 109.497 -179.792 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.522 ' CG ' ' HG1' ' A' ' 68' ' ' THR . 55.1 t0 -86.68 118.77 26.3 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.3 -0.875 . . . . 0.0 109.456 179.956 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 65.3 t80 -81.44 -37.57 27.84 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.245 -0.909 . . . . 0.0 109.463 -179.519 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 24.4 mmt180 -63.95 -43.32 96.19 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.201 -0.937 . . . . 0.0 109.483 -179.054 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' THR . . . . . 0.522 ' HG1' ' CG ' ' A' ' 65' ' ' ASP . 71.1 p -95.61 -19.74 19.52 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.294 -0.879 . . . . 0.0 109.483 -179.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . 0.402 ' HA3' ' NH1' ' A' ' 19' ' ' ARG . . . 67.57 53.14 26.0 Favored Glycine 0 N--CA 1.489 2.232 0 N-CA-C 109.549 -1.421 . . . . 0.0 109.549 178.943 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 19.8 ptmt -150.3 151.77 33.46 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.199 -1.177 . . . . 0.0 109.433 179.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 38.1 ttm -95.22 124.81 39.45 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.22 -0.925 . . . . 0.0 109.494 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 60.5 tp . . . . . 0 N--CA 1.49 1.553 0 O-C-N 121.262 -0.899 . . . . 0.0 109.472 -179.603 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 66.7 ttp85 . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 40.1 mttt -103.54 107.7 18.65 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.176 -0.952 . . . . 0.0 109.442 -179.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 3.4 ptp180 -70.07 167.01 18.57 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.241 -0.912 . . . . 0.0 109.487 -179.466 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.802 ' HE1' ' H ' ' A' ' 21' ' ' GLU . 60.9 m95 -143.33 129.42 19.69 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.246 -0.909 . . . . 0.0 109.499 179.827 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -58.06 139.12 55.28 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.25 -0.907 . . . . 0.0 109.546 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -71.16 126.92 91.98 Favored Pre-proline 0 N--CA 1.491 1.589 0 O-C-N 121.237 -0.915 . . . . 0.0 109.456 -179.717 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -74.06 -59.72 0.05 OUTLIER 'Trans proline' 0 C--N 1.303 -1.818 0 C-N-CA 122.823 2.348 . . . . 0.0 112.198 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.489 ' CB ' ' SD ' ' A' ' 71' ' ' MET . . . -116.28 -28.95 6.37 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.325 -0.859 . . . . 0.0 109.476 179.322 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.462 ' C ' ' O ' ' A' ' 12' ' ' ALA . 5.3 mp -40.7 157.49 0.18 Allowed Pre-proline 0 N--CA 1.491 1.608 0 O-C-N 121.177 -0.952 . . . . 0.0 109.462 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . 0.494 ' HG2' ' CD1' ' A' ' 17' ' ' TRP . 34.0 Cg_endo -66.29 151.69 82.8 Favored 'Trans proline' 0 C--N 1.305 -1.746 0 C-N-CA 122.836 2.358 . . . . 0.0 112.205 179.042 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -58.58 123.45 16.31 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.268 -0.895 . . . . 0.0 109.498 -178.518 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 125.69 -27.14 5.26 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.489 -1.444 . . . . 0.0 109.489 178.419 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . 0.494 ' CD1' ' HG2' ' A' ' 14' ' ' PRO . 15.5 m95 -84.78 143.23 29.25 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.235 -1.156 . . . . 0.0 109.441 179.585 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 75.1 tt0 -136.13 151.85 50.2 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.261 -0.899 . . . . 0.0 109.544 -178.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.411 ' NH1' ' HA3' ' A' ' 69' ' ' GLY . 26.5 mtm105 -121.88 163.25 19.55 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.242 -0.911 . . . . 0.0 109.445 178.373 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -155.78 128.53 7.92 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.214 -0.929 . . . . 0.0 109.492 -179.513 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.802 ' H ' ' HE1' ' A' ' 8' ' ' TRP . 92.0 mt-10 -89.8 134.19 34.32 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.278 -0.889 . . . . 0.0 109.324 178.858 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.524 ' O ' ' OD1' ' A' ' 34' ' ' ASP . 25.5 t -137.25 100.43 9.49 Favored Pre-proline 0 N--CA 1.49 1.557 0 O-C-N 121.225 -0.922 . . . . 0.0 109.61 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_exo -54.6 131.35 45.18 Favored 'Trans proline' 0 C--N 1.304 -1.789 0 C-N-CA 122.822 2.348 . . . . 0.0 112.207 179.001 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 84.4 mtp180 . . . . . 0 N--CA 1.491 1.588 0 O-C-N 121.206 -0.934 . . . . 0.0 109.53 179.602 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 30.3 m170 . . . . . 0 N--CA 1.49 1.542 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -113.24 133.15 55.23 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.274 -0.891 . . . . 0.0 109.556 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.524 ' OD1' ' O ' ' A' ' 22' ' ' VAL . 7.5 p30 -104.25 136.65 43.46 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.352 -0.843 . . . . 0.0 109.484 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 38.9 t -110.79 134.78 51.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.358 -0.839 . . . . 0.0 109.477 179.317 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -114.36 149.49 36.02 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.294 -0.878 . . . . 0.0 109.516 -179.616 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.563 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 17.1 m-85 -118.83 149.82 40.88 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.197 -0.939 . . . . 0.0 109.467 179.515 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.436 ' CD1' ' N ' ' A' ' 38' ' ' TYR . 15.0 m-85 -129.86 140.3 51.02 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.184 -0.947 . . . . 0.0 109.616 -179.696 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.43 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -109.74 176.94 1.36 Allowed Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.266 -0.896 . . . . 0.0 109.403 179.665 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.43 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 52.2 Cg_exo -53.26 -33.27 64.53 Favored 'Trans proline' 0 C--N 1.305 -1.741 0 C-N-CA 122.872 2.382 . . . . 0.0 112.246 179.551 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 20.9 t -76.41 -5.28 46.65 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.255 -0.903 . . . . 0.0 109.475 179.603 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 80.28 15.04 79.4 Favored Glycine 0 N--CA 1.489 2.206 0 N-CA-C 109.496 -1.442 . . . . 0.0 109.496 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -78.24 124.86 28.56 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.273 -1.134 . . . . 0.0 109.461 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.8 ptmm? -95.16 121.6 36.97 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.256 -0.903 . . . . 0.0 109.586 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -142.71 155.04 44.83 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.268 -0.895 . . . . 0.0 109.477 178.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.72 ' O ' ' C ' ' A' ' 47' ' ' SER . 5.0 ptt180 -130.77 -66.71 0.75 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.271 -0.893 . . . . 0.0 109.491 179.16 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.72 ' C ' ' O ' ' A' ' 46' ' ' ARG . 1.7 m -15.82 125.91 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.337 -0.852 . . . . 0.0 109.559 179.226 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.621 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 5.1 tmtp? -59.58 -45.56 98.7 Favored Pre-proline 0 N--CA 1.491 1.617 0 O-C-N 121.296 -0.877 . . . . 0.0 109.408 -179.646 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.621 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 52.5 Cg_exo -53.85 -46.08 36.28 Favored 'Trans proline' 0 C--N 1.305 -1.755 0 C-N-CA 122.837 2.358 . . . . 0.0 112.208 -179.42 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -66.41 -35.74 81.08 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.281 -0.887 . . . . 0.0 109.536 179.347 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 62.3 tp -63.04 -45.32 92.85 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.279 -0.888 . . . . 0.0 109.477 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.627 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -67.27 -40.58 86.18 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.174 -0.954 . . . . 0.0 109.472 -179.5 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 82.6 mtp180 -60.88 -42.14 97.37 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.331 -0.855 . . . . 0.0 109.517 -179.424 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 24.5 t80 -60.99 -53.83 52.45 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.189 -0.944 . . . . 0.0 109.464 -179.713 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.521 ' O ' ' N ' ' A' ' 57' ' ' GLY . 93.2 mt -88.13 1.89 53.3 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.29 -0.881 . . . . 0.0 109.504 179.356 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . 0.627 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -44.67 94.69 0.01 OUTLIER Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.46 -1.456 . . . . 0.0 109.46 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . 0.521 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . 125.05 -52.33 0.8 Allowed Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.465 -1.454 . . . . 0.0 109.465 179.837 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.1 m -63.0 -34.6 77.89 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.213 -1.169 . . . . 0.0 109.454 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 51.6 ttp -163.98 157.81 18.92 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.251 -0.906 . . . . 0.0 109.465 -179.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 51.4 t0 -89.38 110.26 21.09 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.252 -0.905 . . . . 0.0 109.512 -179.688 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.518 ' CD2' ' N ' ' A' ' 61' ' ' LEU . 4.0 mm? -93.78 -3.76 51.51 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.267 -0.896 . . . . 0.0 109.469 -179.733 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 38.4 t -59.45 -39.49 83.77 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.216 -0.927 . . . . 0.0 109.395 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 65.9 p -86.71 14.55 6.87 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.182 -0.949 . . . . 0.0 109.424 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -91.55 129.64 37.5 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.177 -0.952 . . . . 0.0 109.462 -179.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.52 ' O ' ' N ' ' A' ' 69' ' ' GLY . 60.9 t0 -80.03 112.19 17.1 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.196 -0.94 . . . . 0.0 109.472 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.563 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 48.2 t80 -75.13 -44.15 48.59 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.233 -0.917 . . . . 0.0 109.468 -179.006 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.403 ' HD2' ' N ' ' A' ' 67' ' ' ARG . 10.9 mpt_? -60.34 -42.52 95.88 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.198 -0.939 . . . . 0.0 109.518 -178.794 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' THR . . . . . 0.482 ' OG1' ' CG ' ' A' ' 65' ' ' ASP . 30.0 p -97.83 -13.85 21.08 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.302 -0.874 . . . . 0.0 109.497 -179.459 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . 0.52 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 63.25 39.47 97.92 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.481 -1.448 . . . . 0.0 109.481 -179.841 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 51.4 mttp -137.35 156.55 48.09 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.223 -1.163 . . . . 0.0 109.461 -179.487 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.489 ' SD ' ' CB ' ' A' ' 12' ' ' ALA . 37.2 mtt -84.95 148.47 26.2 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.199 -0.938 . . . . 0.0 109.442 -180.0 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 56.0 tp . . . . . 0 N--CA 1.49 1.546 0 O-C-N 121.282 -0.886 . . . . 0.0 109.446 179.967 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 35.3 ptt180 . . . . . 0 N--CA 1.489 1.517 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.446 ' N ' ' HD3' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -114.39 113.09 24.05 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.244 -0.91 . . . . 0.0 109.442 179.883 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.52 ' NH2' ' OE1' ' A' ' 18' ' ' GLU . 69.4 mtp85 -72.01 168.06 18.84 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.273 -0.892 . . . . 0.0 109.38 -179.932 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.59 ' N ' ' O ' ' A' ' 19' ' ' ARG . 53.0 m95 -136.28 124.7 23.42 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.197 -0.939 . . . . 0.0 109.427 -179.418 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.521 ' N ' ' OE1' ' A' ' 9' ' ' GLU . 58.5 mp0 -90.78 117.07 29.12 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.279 -0.888 . . . . 0.0 109.398 179.769 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 46.4 t -119.24 100.32 50.15 Favored Pre-proline 0 N--CA 1.491 1.608 0 O-C-N 121.34 -0.85 . . . . 0.0 109.522 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_exo -55.2 -25.44 46.38 Favored 'Trans proline' 0 C--N 1.305 -1.749 0 C-N-CA 122.945 2.43 . . . . 0.0 112.19 178.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.45 -35.08 69.65 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.267 -0.895 . . . . 0.0 109.47 -179.81 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.613 ' CD2' ' N ' ' A' ' 13' ' ' LEU . 3.2 mm? -89.97 154.9 47.64 Favored Pre-proline 0 N--CA 1.49 1.555 0 O-C-N 121.201 -0.937 . . . . 0.0 109.402 179.793 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_exo -52.1 146.7 29.4 Favored 'Trans proline' 0 C--N 1.306 -1.709 0 C-N-CA 122.78 2.32 . . . . 0.0 112.231 179.064 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 8.7 mp0 -55.29 124.08 15.89 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.252 -0.905 . . . . 0.0 109.509 -179.757 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 124.31 -22.47 6.64 Favored Glycine 0 N--CA 1.49 2.243 0 N-CA-C 109.647 -1.381 . . . . 0.0 109.647 179.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 52.4 m95 -85.36 136.16 33.59 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.177 -1.19 . . . . 0.0 109.473 179.205 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.52 ' OE1' ' NH2' ' A' ' 7' ' ' ARG . 72.4 mt-10 -142.41 155.7 45.14 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.326 -0.859 . . . . 0.0 109.424 -179.126 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.602 HH22 ' CD2' ' A' ' 13' ' ' LEU . 0.0 OUTLIER -138.56 140.24 38.97 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.211 -0.93 . . . . 0.0 109.399 178.953 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -132.89 142.59 49.0 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.241 -0.912 . . . . 0.0 109.481 -178.365 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.495 ' HG3' ' HE1' ' A' ' 8' ' ' TRP . 92.4 mt-10 -98.99 142.58 30.3 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.376 -0.827 . . . . 0.0 109.392 178.391 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 10.4 t -145.17 123.39 6.53 Favored Pre-proline 0 N--CA 1.491 1.598 0 O-C-N 121.219 -0.925 . . . . 0.0 109.611 -179.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -74.84 135.55 19.56 Favored 'Trans proline' 0 C--N 1.304 -1.813 0 C-N-CA 122.879 2.386 . . . . 0.0 112.214 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 78.3 mtp85 . . . . . 0 N--CA 1.49 1.569 0 O-C-N 121.273 -0.892 . . . . 0.0 109.484 179.652 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 33.2 m170 . . . . . 0 N--CA 1.49 1.539 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -114.98 128.04 56.04 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.245 -0.909 . . . . 0.0 109.518 -179.52 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 22.7 m-20 -106.92 137.42 45.01 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.211 -0.931 . . . . 0.0 109.419 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 3.0 t -106.91 135.03 46.83 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.246 -0.909 . . . . 0.0 109.411 179.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -113.7 141.54 47.11 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.313 -0.867 . . . . 0.0 109.524 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.709 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 17.5 m-85 -114.36 142.05 46.83 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.281 -0.887 . . . . 0.0 109.357 -179.352 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 86.2 m-85 -123.06 135.09 54.27 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.307 -0.871 . . . . 0.0 109.47 -179.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.454 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -97.2 177.56 1.63 Allowed Pre-proline 0 N--CA 1.491 1.592 0 O-C-N 121.191 -0.943 . . . . 0.0 109.426 179.593 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.454 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 47.4 Cg_exo -54.49 -31.37 68.78 Favored 'Trans proline' 0 C--N 1.304 -1.809 0 C-N-CA 122.848 2.365 . . . . 0.0 112.258 -179.656 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 71.8 m -88.62 7.08 35.21 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.316 -0.865 . . . . 0.0 109.476 179.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 79.95 10.7 85.33 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 -179.584 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -64.22 122.75 17.37 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.168 -1.195 . . . . 0.0 109.457 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 13.5 ptpt -95.88 126.88 41.44 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.242 -0.911 . . . . 0.0 109.525 178.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.634 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 1.1 p90 -139.92 146.46 39.24 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.296 -0.877 . . . . 0.0 109.47 -179.919 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 28.4 ptt-85 -134.79 53.59 1.98 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.3 -0.875 . . . . 0.0 109.549 179.213 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.4 p -159.41 144.71 15.77 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.285 -0.884 . . . . 0.0 109.563 -179.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.666 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 0.6 OUTLIER -69.39 -42.29 20.06 Favored Pre-proline 0 N--CA 1.49 1.545 0 O-C-N 121.211 -0.931 . . . . 0.0 109.4 -179.473 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.666 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 42.9 Cg_exo -57.54 -48.98 14.83 Favored 'Trans proline' 0 C--N 1.305 -1.752 0 C-N-CA 122.898 2.399 . . . . 0.0 112.231 -179.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.402 HE21 ' CB ' ' A' ' 45' ' ' PHE . 18.3 tt0 -65.84 -38.07 87.89 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.275 -0.891 . . . . 0.0 109.388 179.54 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 37.0 tp -64.02 -45.41 89.02 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.274 -0.891 . . . . 0.0 109.493 -179.636 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.591 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -65.86 -43.98 86.77 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.262 -0.899 . . . . 0.0 109.425 -179.665 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 15.1 tpp180 -56.06 -42.88 77.33 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.251 -0.905 . . . . 0.0 109.448 -179.419 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 56.2 t80 -61.1 -52.14 66.17 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.207 -0.933 . . . . 0.0 109.387 -179.215 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.416 ' O ' ' C ' ' A' ' 56' ' ' GLY . 2.5 pp -86.9 0.94 54.14 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.228 -0.92 . . . . 0.0 109.492 179.718 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . 0.591 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . 44.17 -121.8 4.06 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 -179.743 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -110.01 31.71 7.27 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.595 -1.402 . . . . 0.0 109.595 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 38.2 t -87.82 -21.11 25.25 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.228 -1.16 . . . . 0.0 109.458 -179.579 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 63.8 mmm -139.07 130.39 26.93 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.173 -0.954 . . . . 0.0 109.454 -179.64 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 63.0 t0 -90.79 106.38 18.47 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.272 -0.893 . . . . 0.0 109.479 179.191 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.416 ' O ' ' C ' ' A' ' 62' ' ' SER . 98.6 mt -93.47 4.44 53.95 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.23 -0.919 . . . . 0.0 109.487 -179.308 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.416 ' C ' ' O ' ' A' ' 61' ' ' LEU . 39.7 t -42.9 -39.71 2.66 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.285 -0.884 . . . . 0.0 109.484 179.577 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 67.9 p -98.57 48.39 0.98 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.238 -0.914 . . . . 0.0 109.417 179.345 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -124.25 131.0 53.5 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.299 -0.875 . . . . 0.0 109.482 -179.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.459 ' CG ' ' OG1' ' A' ' 68' ' ' THR . 55.7 t0 -89.94 104.59 17.14 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.125 -0.984 . . . . 0.0 109.463 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.709 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 68.2 t80 -74.16 -49.34 24.04 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.195 -0.94 . . . . 0.0 109.501 -179.231 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 19.0 mmm180 -51.43 -37.6 49.45 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.171 -0.956 . . . . 0.0 109.449 -179.624 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' THR . . . . . 0.459 ' OG1' ' CG ' ' A' ' 65' ' ' ASP . 22.3 p -100.45 -11.21 20.38 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.265 -0.897 . . . . 0.0 109.481 -179.881 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 62.12 34.23 88.37 Favored Glycine 0 N--CA 1.491 2.361 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 179.768 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 62.0 mttp -127.86 147.38 50.45 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.215 -1.167 . . . . 0.0 109.475 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 3.6 tpt -77.87 140.26 39.32 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.184 -0.947 . . . . 0.0 109.513 179.774 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 60.4 tp . . . . . 0 N--CA 1.49 1.548 0 O-C-N 121.222 -0.924 . . . . 0.0 109.458 179.87 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 88.1 mtm180 . . . . . 0 N--CA 1.49 1.552 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.44 ' CD ' ' N ' ' A' ' 6' ' ' LYS . 11.3 mptt -76.06 139.97 41.67 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.365 -0.835 . . . . 0.0 109.521 179.742 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -157.44 92.3 1.22 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.265 -0.897 . . . . 0.0 109.508 -179.558 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.619 ' HE1' ' HE ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -122.27 149.22 44.01 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.19 -0.944 . . . . 0.0 109.509 179.304 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -62.7 150.83 40.04 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.276 -0.89 . . . . 0.0 109.505 179.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.448 ' SG ' ' C ' ' A' ' 18' ' ' GLU . 10.9 m -93.45 114.3 62.51 Favored Pre-proline 0 N--CA 1.492 1.644 0 O-C-N 121.251 -0.906 . . . . 0.0 109.517 -179.644 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -76.87 -39.4 0.65 Allowed 'Trans proline' 0 C--N 1.306 -1.689 0 C-N-CA 122.821 2.347 . . . . 0.0 112.233 179.389 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.17 -36.39 82.98 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.211 -0.931 . . . . 0.0 109.554 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.595 ' CD2' ' N ' ' A' ' 13' ' ' LEU . 3.4 mm? -88.23 156.91 51.26 Favored Pre-proline 0 N--CA 1.49 1.555 0 O-C-N 121.17 -0.956 . . . . 0.0 109.452 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -52.2 142.79 44.61 Favored 'Trans proline' 0 C--N 1.306 -1.692 0 C-N-CA 122.802 2.334 . . . . 0.0 112.154 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 98.5 mm-40 -47.09 131.96 12.36 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.189 -0.944 . . . . 0.0 109.465 -179.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 120.61 -21.65 8.47 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 179.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 18.1 m95 -84.47 147.89 26.84 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.133 -1.216 . . . . 0.0 109.473 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.448 ' C ' ' SG ' ' A' ' 10' ' ' CYS . 94.1 mt-10 -127.51 148.14 50.32 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.274 -0.891 . . . . 0.0 109.42 -178.679 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.631 ' NH1' ' O ' ' A' ' 68' ' ' THR . 52.0 ttp180 -130.83 126.22 35.69 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.249 -0.907 . . . . 0.0 109.474 179.51 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -129.63 139.03 51.53 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.227 -0.921 . . . . 0.0 109.499 -179.537 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.44 ' H ' ' HB2' ' A' ' 6' ' ' LYS . 77.9 tt0 -101.51 145.63 28.74 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.325 -0.859 . . . . 0.0 109.362 179.06 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.5 t -142.56 121.82 7.74 Favored Pre-proline 0 N--CA 1.49 1.572 0 O-C-N 121.115 -0.991 . . . . 0.0 109.54 -179.159 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -78.73 144.57 19.59 Favored 'Trans proline' 0 C--N 1.305 -1.755 0 C-N-CA 122.797 2.331 . . . . 0.0 112.161 178.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.772 ' H ' ' NE ' ' A' ' 24' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.564 0 O-C-N 121.181 -0.949 . . . . 0.0 109.489 179.563 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . 0.595 ' O ' ' NE ' ' A' ' 24' ' ' ARG . 75.7 m80 . . . . . 0 N--CA 1.491 1.58 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 7.4 mtp180 -112.08 118.82 36.46 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.218 -0.927 . . . . 0.0 109.492 179.554 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -91.96 139.49 30.6 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.235 -0.916 . . . . 0.0 109.394 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.6 t -106.7 123.03 61.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.271 -0.893 . . . . 0.0 109.405 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -107.36 140.61 40.02 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.208 -0.933 . . . . 0.0 109.47 179.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.544 ' CD1' ' CE1' ' A' ' 66' ' ' PHE . 71.9 m-85 -109.4 142.25 40.62 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.251 -0.906 . . . . 0.0 109.471 -179.216 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 80.2 m-85 -126.39 139.29 53.39 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.242 -0.911 . . . . 0.0 109.496 -179.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.409 ' CB ' ' HD2' ' A' ' 40' ' ' PRO . 0.4 OUTLIER -99.7 165.22 15.07 Favored Pre-proline 0 N--CA 1.49 1.568 0 O-C-N 121.362 -0.836 . . . . 0.0 109.443 179.53 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.409 ' HD2' ' CB ' ' A' ' 39' ' ' SER . 20.5 Cg_endo -60.47 -19.1 57.59 Favored 'Trans proline' 0 C--N 1.305 -1.747 0 C-N-CA 122.805 2.337 . . . . 0.0 112.201 179.833 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 56.7 p -88.52 0.04 56.73 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.361 -0.837 . . . . 0.0 109.511 179.411 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 85.6 13.11 70.91 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -78.21 117.66 19.7 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.204 -1.174 . . . . 0.0 109.479 -179.773 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.687 ' NZ ' HH11 ' A' ' 46' ' ' ARG . 62.8 tttm -92.81 128.37 38.64 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.295 -0.878 . . . . 0.0 109.402 178.689 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.635 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 1.1 p90 -140.24 146.8 39.12 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.202 -0.936 . . . . 0.0 109.479 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.687 HH11 ' NZ ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -141.7 59.78 1.49 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.218 -0.926 . . . . 0.0 109.525 179.008 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.1 t -157.73 144.97 18.29 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.231 -0.918 . . . . 0.0 109.568 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.603 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 3.8 tttt -68.5 -46.06 36.23 Favored Pre-proline 0 N--CA 1.49 1.575 0 O-C-N 121.176 -0.953 . . . . 0.0 109.437 -179.355 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.603 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 45.6 Cg_exo -55.77 -46.72 29.59 Favored 'Trans proline' 0 C--N 1.306 -1.695 0 C-N-CA 122.77 2.314 . . . . 0.0 112.23 -179.689 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -67.16 -39.94 86.57 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.208 -0.933 . . . . 0.0 109.447 179.794 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 57.0 tp -64.87 -45.81 84.44 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.252 -0.905 . . . . 0.0 109.497 -179.476 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.691 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -69.98 -45.3 67.63 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.271 -0.893 . . . . 0.0 109.474 -179.288 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 77.5 ttt-85 -60.18 -43.52 95.78 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.2 -0.938 . . . . 0.0 109.545 -179.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 37.5 t80 -62.43 -55.61 26.06 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.293 -0.879 . . . . 0.0 109.518 -179.114 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.623 ' CA ' ' HG ' ' A' ' 58' ' ' SER . 96.4 mt -90.34 4.92 49.4 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.202 -0.936 . . . . 0.0 109.532 179.885 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . 0.691 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -48.6 -77.37 0.12 Allowed Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 -179.643 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.09 7.47 0.2 Allowed Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 -179.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.623 ' HG ' ' CA ' ' A' ' 55' ' ' LEU . 3.6 p -108.77 -26.85 10.09 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.209 -1.171 . . . . 0.0 109.498 -179.61 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.408 ' N ' ' O ' ' A' ' 55' ' ' LEU . 18.1 ptm -176.2 170.13 2.68 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.192 -0.942 . . . . 0.0 109.431 -179.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.518 ' O ' ' OD1' ' A' ' 60' ' ' ASP . 45.3 p-10 -97.24 116.47 29.51 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.317 -0.865 . . . . 0.0 109.452 179.655 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 88.5 mt -111.8 16.45 20.45 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.352 -0.843 . . . . 0.0 109.463 -179.414 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 41.0 t -58.77 -39.28 80.57 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.284 -0.885 . . . . 0.0 109.436 -179.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 51.7 p -92.03 23.98 3.48 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.357 -0.84 . . . . 0.0 109.413 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 46.5 t80 -99.72 125.71 45.65 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.248 -0.907 . . . . 0.0 109.476 -179.729 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.465 ' OD2' ' OG1' ' A' ' 68' ' ' THR . 55.3 t0 -83.63 119.31 24.6 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.261 -0.899 . . . . 0.0 109.418 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.544 ' CE1' ' CD1' ' A' ' 37' ' ' TYR . 73.8 t80 -83.02 -33.23 26.55 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.235 -0.916 . . . . 0.0 109.541 -179.541 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 42.3 ttm180 -66.18 -43.94 85.43 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.264 -0.897 . . . . 0.0 109.529 -179.214 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' THR . . . . . 0.631 ' O ' ' NH1' ' A' ' 19' ' ' ARG . 11.3 p -96.47 -15.91 21.45 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.278 -0.889 . . . . 0.0 109.503 -179.867 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . 0.515 ' HA3' HH11 ' A' ' 19' ' ' ARG . . . 64.52 60.45 7.02 Favored Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.497 -1.441 . . . . 0.0 109.497 179.375 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -152.96 149.74 28.52 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.318 -1.107 . . . . 0.0 109.423 179.599 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 34.6 ttm -91.63 121.41 33.27 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.208 -0.932 . . . . 0.0 109.522 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 3.4 tt . . . . . 0 N--CA 1.491 1.598 0 O-C-N 121.278 -0.889 . . . . 0.0 109.458 -179.849 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.7 ptp180 . . . . . 0 N--CA 1.49 1.549 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.594 ' NZ ' ' O ' ' A' ' 21' ' ' GLU . 0.3 OUTLIER -120.68 123.35 42.53 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.294 -0.879 . . . . 0.0 109.526 179.948 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 83.7 mtp180 -100.66 108.44 20.32 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.246 -0.909 . . . . 0.0 109.501 -179.306 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 15.2 m0 -104.37 169.71 8.32 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.212 -0.93 . . . . 0.0 109.472 178.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -88.83 146.04 25.21 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.212 -0.93 . . . . 0.0 109.408 -179.661 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 17.8 t -121.34 100.73 44.67 Favored Pre-proline 0 N--CA 1.489 1.484 0 O-C-N 121.247 -0.908 . . . . 0.0 109.499 179.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -53.11 -40.18 77.7 Favored 'Trans proline' 0 C--N 1.304 -1.776 0 C-N-CA 122.864 2.376 . . . . 0.0 112.23 -179.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.42 -28.95 60.9 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.262 -0.899 . . . . 0.0 109.52 -179.725 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 14.5 mt -91.67 151.38 42.31 Favored Pre-proline 0 N--CA 1.49 1.53 0 O-C-N 121.302 -0.874 . . . . 0.0 109.436 -179.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -51.1 154.6 7.34 Favored 'Trans proline' 0 C--N 1.306 -1.709 0 C-N-CA 122.746 2.297 . . . . 0.0 112.256 179.029 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 89.5 mt-30 -58.25 121.02 9.73 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.254 -0.904 . . . . 0.0 109.477 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 124.52 -36.19 2.97 Favored Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 -179.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . 0.416 ' N ' ' CD1' ' A' ' 17' ' ' TRP . 37.5 m95 -74.61 149.02 40.22 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.219 -1.165 . . . . 0.0 109.453 178.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -139.46 153.35 47.53 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.139 -0.976 . . . . 0.0 109.489 -178.437 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.552 ' NH1' ' O ' ' A' ' 68' ' ' THR . 60.8 ttp180 -106.56 156.44 18.58 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.179 -0.951 . . . . 0.0 109.423 178.544 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -142.53 140.53 31.84 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.226 -0.921 . . . . 0.0 109.557 -178.572 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.594 ' O ' ' NZ ' ' A' ' 6' ' ' LYS . 81.2 mm-40 -113.92 121.04 42.74 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.187 -0.945 . . . . 0.0 109.407 178.004 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 39.2 t -128.79 133.78 25.58 Favored Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.215 -0.928 . . . . 0.0 109.609 -178.671 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -76.47 171.45 18.04 Favored 'Trans proline' 0 C--N 1.306 -1.703 0 C-N-CA 122.825 2.35 . . . . 0.0 112.221 178.21 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.548 ' NE ' ' OD2' ' A' ' 34' ' ' ASP . 12.7 mmt85 . . . . . 0 N--CA 1.49 1.56 0 O-C-N 121.333 -0.854 . . . . 0.0 109.366 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 36.2 m80 . . . . . 0 N--CA 1.489 1.515 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 19.1 ptp180 -128.94 150.75 50.25 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.212 -0.93 . . . . 0.0 109.493 -179.491 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.548 ' OD2' ' NE ' ' A' ' 24' ' ' ARG . 69.5 m-20 -129.68 146.24 51.47 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.264 -0.897 . . . . 0.0 109.454 179.497 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 33.3 t -105.06 132.4 51.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.225 -0.922 . . . . 0.0 109.446 -179.258 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 81.3 m-85 -122.75 152.45 40.61 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.161 -0.962 . . . . 0.0 109.505 179.137 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 68.0 m-85 -123.87 149.29 45.97 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.193 -0.942 . . . . 0.0 109.49 -179.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 53.5 m-85 -116.08 128.19 55.48 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.263 -0.898 . . . . 0.0 109.643 -179.397 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.535 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.5 OUTLIER -92.61 -177.94 0.8 Allowed Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.299 -0.876 . . . . 0.0 109.444 179.195 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.535 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 51.2 Cg_exo -55.37 -31.44 77.36 Favored 'Trans proline' 0 C--N 1.305 -1.746 0 C-N-CA 122.885 2.39 . . . . 0.0 112.248 -179.544 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.46 ' OG ' ' O ' ' A' ' 41' ' ' SER . 0.1 OUTLIER -93.05 11.81 26.28 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.184 -0.947 . . . . 0.0 109.528 179.019 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 73.66 14.85 79.54 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 -179.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.506 ' HZ2' HE21 ' A' ' 50' ' ' GLN . 5.6 ttmt -64.36 128.73 37.05 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.175 -1.191 . . . . 0.0 109.44 -179.504 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 9.8 mtpm? -94.45 118.09 31.12 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.282 -0.886 . . . . 0.0 109.455 178.685 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 55.0 p90 -139.4 146.21 39.89 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.284 -0.885 . . . . 0.0 109.44 -179.638 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 26.6 ptt180 -126.32 57.78 1.39 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.336 -0.852 . . . . 0.0 109.493 179.345 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.5 t -150.45 130.33 13.33 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.236 -0.915 . . . . 0.0 109.504 179.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.863 ' N ' ' HD2' ' A' ' 49' ' ' PRO . 7.6 tmtt? -63.48 -46.81 84.17 Favored Pre-proline 0 N--CA 1.49 1.533 0 O-C-N 121.222 -0.924 . . . . 0.0 109.503 -179.915 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.863 ' HD2' ' N ' ' A' ' 48' ' ' LYS . 18.3 Cg_endo -57.95 -37.08 97.43 Favored 'Trans proline' 0 C--N 1.305 -1.734 0 C-N-CA 122.812 2.341 . . . . 0.0 112.235 178.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.506 HE21 ' HZ2' ' A' ' 43' ' ' LYS . 59.2 tt0 -67.66 -38.28 83.57 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.207 -0.933 . . . . 0.0 109.478 179.277 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 2.0 tt -63.64 -42.32 98.14 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.26 -0.9 . . . . 0.0 109.505 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.89 -39.75 90.94 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.28 -0.888 . . . . 0.0 109.491 -179.551 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 13.6 tpp180 -55.9 -45.98 78.48 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.254 -0.904 . . . . 0.0 109.521 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . 0.434 ' C ' ' H ' ' A' ' 56' ' ' GLY . 31.8 t80 -62.59 -47.87 81.9 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.24 -0.913 . . . . 0.0 109.484 179.537 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 8.1 mp -65.26 -0.59 1.84 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.291 -0.88 . . . . 0.0 109.437 179.504 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . 0.551 ' O ' ' C ' ' A' ' 57' ' ' GLY . . . 56.37 60.36 9.09 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.616 -1.394 . . . . 0.0 109.616 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . 0.551 ' C ' ' O ' ' A' ' 56' ' ' GLY . . . 34.34 38.41 0.11 Allowed Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 -179.351 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.468 ' N ' ' O ' ' A' ' 56' ' ' GLY . 89.0 p -88.95 -0.89 57.79 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.294 -1.121 . . . . 0.0 109.436 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 33.1 ttp -155.46 148.74 24.82 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.224 -0.922 . . . . 0.0 109.548 -179.736 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 55.1 t0 -85.76 101.81 13.11 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.232 -0.917 . . . . 0.0 109.482 -179.585 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 89.1 mt -96.41 1.18 51.47 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.258 -0.901 . . . . 0.0 109.449 179.56 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 58.6 m -54.93 -27.19 41.49 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.143 -0.973 . . . . 0.0 109.458 179.585 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 36.1 p -94.11 1.46 56.13 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.27 -0.894 . . . . 0.0 109.547 179.563 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.424 ' CZ ' ' HA2' ' A' ' 69' ' ' GLY . 72.9 t80 -87.87 114.52 24.56 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.247 -0.908 . . . . 0.0 109.512 179.459 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -76.23 136.81 39.69 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.268 -0.895 . . . . 0.0 109.465 -179.498 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 69.4 t80 -89.15 -37.34 15.13 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.144 -0.972 . . . . 0.0 109.44 179.446 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 29.0 tpt85 -59.35 -44.44 92.67 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.278 -0.889 . . . . 0.0 109.461 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' THR . . . . . 0.552 ' O ' ' NH1' ' A' ' 19' ' ' ARG . 33.1 p -97.54 -20.53 17.65 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.324 -0.86 . . . . 0.0 109.485 179.659 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . 0.449 ' HA3' HH11 ' A' ' 19' ' ' ARG . . . 67.21 31.46 77.47 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.56 -1.416 . . . . 0.0 109.56 179.667 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 64.6 mttp -132.11 152.58 51.15 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.232 -1.157 . . . . 0.0 109.525 -179.655 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 17.4 mtt -78.73 144.53 35.16 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.211 -0.931 . . . . 0.0 109.466 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.456 ' C ' ' CD2' ' A' ' 72' ' ' LEU . 5.1 tt . . . . . 0 N--CA 1.49 1.564 0 O-C-N 121.213 -0.929 . . . . 0.0 109.413 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.584 ' NH2' ' OE2' ' A' ' 20' ' ' GLU . 50.0 mtp180 . . . . . 0 N--CA 1.489 1.516 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.404 ' HD2' ' N ' ' A' ' 6' ' ' LYS . 10.9 mptt -74.68 158.29 33.84 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.304 -0.872 . . . . 0.0 109.452 -179.0 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 79.8 mtp180 -150.92 140.26 21.37 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.246 -0.909 . . . . 0.0 109.456 -179.171 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.589 ' CD1' ' N ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -167.75 140.88 3.31 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.228 -0.92 . . . . 0.0 109.389 179.213 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -87.68 136.13 33.08 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.168 -0.957 . . . . 0.0 109.465 178.586 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 32.8 m -94.03 141.05 23.16 Favored Pre-proline 0 N--CA 1.489 1.511 0 O-C-N 121.149 -0.969 . . . . 0.0 109.505 -179.701 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -70.27 -14.81 34.89 Favored 'Trans proline' 0 C--N 1.304 -1.773 0 C-N-CA 122.893 2.396 . . . . 0.0 112.249 179.713 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -90.78 -11.71 38.64 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.206 -0.934 . . . . 0.0 109.483 179.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 7.7 mp -99.71 148.95 35.46 Favored Pre-proline 0 N--CA 1.49 1.553 0 O-C-N 121.183 -0.948 . . . . 0.0 109.456 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . 0.404 ' HG2' ' CD1' ' A' ' 17' ' ' TRP . 47.2 Cg_endo -70.21 148.88 63.15 Favored 'Trans proline' 0 C--N 1.305 -1.738 0 C-N-CA 122.858 2.372 . . . . 0.0 112.213 178.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -52.97 129.31 30.12 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.313 -0.867 . . . . 0.0 109.52 -179.463 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 122.84 -25.09 6.56 Favored Glycine 0 N--CA 1.489 2.211 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 179.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . 0.434 ' CD1' ' N ' ' A' ' 17' ' ' TRP . 14.1 m95 -86.76 152.11 22.8 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.226 -1.161 . . . . 0.0 109.479 179.652 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -129.48 147.13 51.26 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.165 -0.96 . . . . 0.0 109.545 -179.422 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.553 ' NH1' ' NE1' ' A' ' 8' ' ' TRP . 75.0 ttt-85 -128.23 125.74 39.55 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.231 -0.918 . . . . 0.0 109.432 179.581 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.588 ' OE2' ' CE1' ' A' ' 38' ' ' TYR . 21.8 pt-20 -134.1 139.34 45.87 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.201 -0.937 . . . . 0.0 109.461 -179.553 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -101.55 151.3 22.14 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.278 -0.888 . . . . 0.0 109.4 -179.778 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.1 t -136.14 122.52 13.99 Favored Pre-proline 0 N--CA 1.491 1.578 0 O-C-N 121.226 -0.921 . . . . 0.0 109.518 -179.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . 0.414 ' CB ' ' NH1' ' A' ' 33' ' ' ARG . 62.0 Cg_endo -77.01 140.14 19.88 Favored 'Trans proline' 0 C--N 1.306 -1.689 0 C-N-CA 122.814 2.342 . . . . 0.0 112.109 -178.766 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 38.5 ttm180 . . . . . 0 N--CA 1.491 1.585 0 O-C-N 121.157 -0.964 . . . . 0.0 109.522 178.5 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . 0.636 ' C ' ' HE ' ' A' ' 33' ' ' ARG . 58.4 m80 . . . . . 0 N--CA 1.492 1.639 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.636 ' HE ' ' C ' ' A' ' 32' ' ' HIS . 0.4 OUTLIER -107.49 107.82 18.85 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.252 -0.905 . . . . 0.0 109.481 -179.261 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.511 ' OD1' ' N ' ' A' ' 35' ' ' VAL . 58.4 t0 -77.8 134.94 37.91 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.303 -0.873 . . . . 0.0 109.505 179.41 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.511 ' N ' ' OD1' ' A' ' 34' ' ' ASP . 47.1 t -105.45 128.13 59.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.247 -0.908 . . . . 0.0 109.47 -179.796 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.418 ' CZ ' ' OD2' ' A' ' 34' ' ' ASP . 72.7 m-85 -115.14 142.89 46.05 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.172 -0.955 . . . . 0.0 109.427 179.251 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 52.8 m-85 -111.22 142.73 43.03 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.273 -0.892 . . . . 0.0 109.462 -179.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.588 ' CE1' ' OE2' ' A' ' 20' ' ' GLU . 19.9 m-85 -118.14 135.85 53.97 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.251 -0.905 . . . . 0.0 109.445 179.793 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.438 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -94.26 176.88 2.13 Favored Pre-proline 0 N--CA 1.49 1.551 0 O-C-N 121.231 -0.918 . . . . 0.0 109.474 179.55 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.438 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 42.1 Cg_exo -55.47 -29.88 71.07 Favored 'Trans proline' 0 C--N 1.304 -1.795 0 C-N-CA 122.897 2.398 . . . . 0.0 112.243 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 66.8 m -91.05 -2.29 57.67 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.176 -0.952 . . . . 0.0 109.548 -179.396 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 88.32 22.1 42.27 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.556 -1.418 . . . . 0.0 109.556 179.748 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.423 ' HE3' HE22 ' A' ' 50' ' ' GLN . 46.9 tttp -75.06 129.13 37.08 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.273 -1.133 . . . . 0.0 109.421 -179.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 47.5 mtpt -94.27 120.87 35.14 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.263 -0.898 . . . . 0.0 109.531 179.301 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.599 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 2.0 p90 -141.68 150.63 42.13 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.197 -0.939 . . . . 0.0 109.389 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 10.6 ptm180 -143.04 68.94 1.3 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.331 -0.855 . . . . 0.0 109.453 179.194 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -148.1 129.45 14.77 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.179 -0.951 . . . . 0.0 109.439 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.639 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -61.2 -42.95 88.52 Favored Pre-proline 0 N--CA 1.488 1.448 0 O-C-N 121.209 -0.932 . . . . 0.0 109.461 -179.33 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.639 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 32.0 Cg_exo -58.2 -40.26 77.93 Favored 'Trans proline' 0 C--N 1.305 -1.752 0 C-N-CA 122.845 2.363 . . . . 0.0 112.242 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.423 HE22 ' HE3' ' A' ' 43' ' ' LYS . 59.5 tt0 -65.79 -38.86 90.15 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.29 -0.881 . . . . 0.0 109.516 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 8.9 mp -65.29 -45.53 84.04 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.223 -0.923 . . . . 0.0 109.46 -179.667 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.667 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -72.35 -48.08 44.64 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.337 -0.852 . . . . 0.0 109.515 -179.379 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 80.1 mtp180 -58.9 -32.52 69.59 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.203 -0.936 . . . . 0.0 109.473 -179.413 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 24.2 t80 -86.01 -55.08 4.11 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.301 -0.875 . . . . 0.0 109.446 -178.55 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.404 ' O ' ' C ' ' A' ' 56' ' ' GLY . 95.2 mt -93.85 6.2 49.18 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.263 -0.898 . . . . 0.0 109.411 -178.217 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . 0.667 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -45.55 -72.29 0.39 Allowed Glycine 0 N--CA 1.492 2.374 0 N-CA-C 109.475 -1.45 . . . . 0.0 109.475 -179.599 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -57.41 -43.7 93.82 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 -179.016 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 54.1 p -58.2 -34.64 70.59 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.243 -1.151 . . . . 0.0 109.44 -179.344 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.404 ' N ' ' O ' ' A' ' 55' ' ' LEU . 1.7 mmm -170.53 162.82 8.23 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.33 -0.856 . . . . 0.0 109.472 -179.61 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 56.2 t0 -95.42 114.69 26.48 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.238 -0.914 . . . . 0.0 109.499 179.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 97.0 mt -106.67 3.13 26.43 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.277 -0.89 . . . . 0.0 109.501 -179.073 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.455 ' HG ' ' N ' ' A' ' 63' ' ' THR . 78.7 p -52.75 -36.76 58.36 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.263 -0.898 . . . . 0.0 109.408 -179.758 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' THR . . . . . 0.455 ' N ' ' HG ' ' A' ' 62' ' ' SER . 54.3 p -81.17 14.45 2.34 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.273 -0.892 . . . . 0.0 109.457 179.894 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.625 ' O ' ' NZ ' ' A' ' 48' ' ' LYS . 47.0 t80 -88.75 133.15 34.33 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.255 -0.903 . . . . 0.0 109.402 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.499 ' O ' ' N ' ' A' ' 69' ' ' GLY . 64.4 t0 -82.87 114.11 20.95 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.299 -0.876 . . . . 0.0 109.48 -179.734 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 64.0 t80 -75.02 -44.89 45.4 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.249 -0.907 . . . . 0.0 109.477 -179.068 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.61 -46.09 84.52 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.314 -0.866 . . . . 0.0 109.459 -179.214 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' THR . . . . . 0.534 ' O ' ' NH2' ' A' ' 19' ' ' ARG . 43.3 p -94.71 -13.45 25.74 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.245 -0.91 . . . . 0.0 109.486 -179.836 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . 0.499 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 61.72 40.23 98.5 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 179.732 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -137.75 157.21 46.92 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.267 -1.137 . . . . 0.0 109.468 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 3.0 ttt -84.6 122.97 29.8 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.197 -0.939 . . . . 0.0 109.422 -179.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 7.2 tt . . . . . 0 N--CA 1.49 1.572 0 O-C-N 121.334 -0.854 . . . . 0.0 109.449 -179.908 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.425 ' N ' ' OE2' ' A' ' 20' ' ' GLU . 8.3 tpm_? . . . . . 0 N--CA 1.49 1.558 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.414 ' N ' ' HG3' ' A' ' 5' ' ' ARG . 7.4 ptmt -115.98 109.81 18.08 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.196 -0.94 . . . . 0.0 109.496 179.465 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -120.88 133.61 55.3 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.22 -0.925 . . . . 0.0 109.493 -179.424 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.413 ' HB2' ' HE ' ' A' ' 19' ' ' ARG . 2.0 m0 -129.82 175.97 8.41 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.232 -0.918 . . . . 0.0 109.502 179.879 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 -75.38 143.39 42.81 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.258 -0.902 . . . . 0.0 109.417 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.2 t -101.93 108.5 56.65 Favored Pre-proline 0 N--CA 1.49 1.575 0 O-C-N 121.259 -0.901 . . . . 0.0 109.448 179.703 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -77.01 -14.99 16.69 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 C-N-CA 122.891 2.394 . . . . 0.0 112.226 -179.223 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -71.39 -40.33 70.62 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.274 -0.891 . . . . 0.0 109.402 -179.746 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.517 ' CB ' ' CD ' ' A' ' 14' ' ' PRO . 0.3 OUTLIER -96.19 -179.59 0.95 Allowed Pre-proline 0 N--CA 1.49 1.527 0 O-C-N 121.236 -0.915 . . . . 0.0 109.433 -179.947 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . 0.517 ' CD ' ' CB ' ' A' ' 13' ' ' LEU . 33.6 Cg_exo -60.34 145.91 97.67 Favored 'Trans proline' 0 C--N 1.306 -1.701 0 C-N-CA 122.786 2.324 . . . . 0.0 112.247 -179.481 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 19.2 mm100 -51.79 128.85 24.94 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.175 -0.953 . . . . 0.0 109.524 -179.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 123.96 -24.17 6.41 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.626 -1.39 . . . . 0.0 109.626 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 31.0 m95 -84.16 145.91 28.13 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.28 -1.129 . . . . 0.0 109.483 179.308 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -138.42 154.93 48.89 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.228 -0.92 . . . . 0.0 109.527 -179.458 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.523 ' CD ' ' H ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -126.59 162.17 26.32 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.294 -0.879 . . . . 0.0 109.474 179.252 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.425 ' OE2' ' N ' ' A' ' 5' ' ' ARG . 78.0 tt0 -143.22 144.55 32.2 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.219 -0.925 . . . . 0.0 109.48 -179.004 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -113.07 132.68 55.32 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.192 -0.942 . . . . 0.0 109.387 179.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.5 t -127.53 108.95 20.89 Favored Pre-proline 0 N--CA 1.491 1.589 0 O-C-N 121.217 -0.927 . . . . 0.0 109.609 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -74.53 142.72 29.84 Favored 'Trans proline' 0 C--N 1.305 -1.713 0 C-N-CA 122.811 2.341 . . . . 0.0 112.127 -178.557 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 80.6 mtp85 . . . . . 0 N--CA 1.489 1.512 0 O-C-N 121.189 -0.944 . . . . 0.0 109.448 179.059 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 78.5 m80 . . . . . 0 N--CA 1.489 1.512 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 36.2 ptt-85 -112.26 132.77 54.76 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.203 -0.935 . . . . 0.0 109.56 -179.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -87.88 142.24 27.96 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.266 -0.896 . . . . 0.0 109.475 179.289 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 59.6 t -112.72 125.74 70.02 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.317 -0.865 . . . . 0.0 109.496 179.91 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 84.0 m-85 -112.98 144.28 42.83 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.238 -0.913 . . . . 0.0 109.518 179.11 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.668 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 49.9 m-85 -112.71 148.46 34.66 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.233 -0.917 . . . . 0.0 109.455 -179.786 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.569 ' CD1' ' N ' ' A' ' 38' ' ' TYR . 3.1 m-85 -127.88 140.37 52.06 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.312 -0.867 . . . . 0.0 109.609 -179.934 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.431 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -96.21 176.64 2.07 Favored Pre-proline 0 N--CA 1.491 1.606 0 O-C-N 121.214 -0.929 . . . . 0.0 109.467 179.775 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.431 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 53.1 Cg_exo -54.29 -30.13 60.86 Favored 'Trans proline' 0 C--N 1.305 -1.728 0 C-N-CA 122.797 2.332 . . . . 0.0 112.252 179.568 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 11.7 t -88.0 -3.27 58.93 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.248 -0.908 . . . . 0.0 109.477 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 87.61 21.97 45.39 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.549 -1.421 . . . . 0.0 109.549 -179.673 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 61.6 tttp -73.57 123.76 24.59 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.306 -1.114 . . . . 0.0 109.452 -179.668 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -90.8 121.59 32.8 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.267 -0.895 . . . . 0.0 109.443 179.331 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.447 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 8.9 p90 -141.07 148.17 39.75 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.21 -0.931 . . . . 0.0 109.511 179.763 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -142.31 70.61 1.33 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.207 -0.933 . . . . 0.0 109.49 179.137 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.5 p -158.67 144.44 16.68 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.296 -0.877 . . . . 0.0 109.423 179.575 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.675 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 12.9 tptt -65.46 -41.71 52.19 Favored Pre-proline 0 N--CA 1.49 1.547 0 O-C-N 121.316 -0.865 . . . . 0.0 109.455 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.675 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 39.0 Cg_exo -57.23 -40.35 83.22 Favored 'Trans proline' 0 C--N 1.306 -1.699 0 C-N-CA 122.839 2.36 . . . . 0.0 112.259 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -68.22 -39.1 82.45 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.202 -0.936 . . . . 0.0 109.46 179.747 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -61.92 -46.34 89.79 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.253 -0.904 . . . . 0.0 109.457 -179.504 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.633 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -73.9 -42.81 60.11 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.339 -0.851 . . . . 0.0 109.452 -179.361 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 75.7 ttt180 -58.59 -47.32 84.72 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.296 -0.877 . . . . 0.0 109.515 -179.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 18.4 t80 -69.8 -53.88 16.19 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.222 -0.924 . . . . 0.0 109.479 -179.454 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.438 ' O ' ' N ' ' A' ' 57' ' ' GLY . 96.0 mt -80.35 0.39 33.27 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.288 -0.883 . . . . 0.0 109.45 -179.142 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . 0.633 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -56.98 89.72 0.01 OUTLIER Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . 0.438 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . 133.18 -1.08 4.49 Favored Glycine 0 N--CA 1.491 2.346 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 -179.885 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 32.2 t -105.23 -31.02 9.3 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.27 -1.135 . . . . 0.0 109.457 179.786 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 3.1 ptp -178.71 176.75 0.94 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.33 -0.856 . . . . 0.0 109.512 -179.831 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -85.86 104.64 15.71 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.214 -0.929 . . . . 0.0 109.436 179.462 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -85.98 -0.89 56.62 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.162 -0.961 . . . . 0.0 109.453 -179.662 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 40.9 t -53.67 -37.64 63.38 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.157 -0.964 . . . . 0.0 109.442 -179.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' THR . . . . . 0.51 ' O ' ' SD ' ' A' ' 71' ' ' MET . 37.8 p -95.23 45.68 1.1 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.207 -0.933 . . . . 0.0 109.43 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 26.3 t80 -121.26 129.86 53.37 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.259 -0.901 . . . . 0.0 109.478 -179.69 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.454 ' O ' ' N ' ' A' ' 69' ' ' GLY . 57.9 t0 -90.2 110.17 21.22 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.266 -0.897 . . . . 0.0 109.418 -179.974 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.668 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 74.6 t80 -77.19 -40.27 45.86 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.233 -0.917 . . . . 0.0 109.445 -179.915 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 26.6 mmt180 -61.07 -39.31 89.4 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.23 -0.919 . . . . 0.0 109.53 -179.609 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' THR . . . . . 0.443 ' OG1' ' CG ' ' A' ' 65' ' ' ASP . 34.6 p -100.35 -15.45 17.98 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.27 -0.894 . . . . 0.0 109.516 -179.528 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . 0.454 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 64.21 42.64 97.84 Favored Glycine 0 N--CA 1.491 2.336 0 N-CA-C 109.542 -1.423 . . . . 0.0 109.542 179.661 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.5 tppt? -135.9 143.46 45.01 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.24 -1.153 . . . . 0.0 109.468 179.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.51 ' SD ' ' O ' ' A' ' 63' ' ' THR . 35.8 tpp -85.23 131.72 34.38 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.244 -0.91 . . . . 0.0 109.5 -179.616 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 4.4 tt . . . . . 0 N--CA 1.491 1.588 0 O-C-N 121.177 -0.952 . . . . 0.0 109.442 -179.761 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 62.9 ttp180 . . . . . 0 N--CA 1.49 1.538 0 CA-C-O 121.324 0.583 . . . . 0.0 109.43 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 56.7 mttt -74.12 163.27 28.07 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.202 -0.936 . . . . 0.0 109.481 179.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.589 ' O ' ' CD1' ' A' ' 8' ' ' TRP . 15.0 mmt180 -142.38 134.03 26.78 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.248 -0.907 . . . . 0.0 109.499 -178.617 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.589 ' CD1' ' O ' ' A' ' 7' ' ' ARG . 5.8 m0 -159.62 132.81 6.95 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.147 -0.97 . . . . 0.0 109.477 179.831 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -73.62 148.55 42.76 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.251 -0.906 . . . . 0.0 109.465 179.286 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 34.1 t -112.69 100.99 52.11 Favored Pre-proline 0 N--CA 1.488 1.448 0 O-C-N 121.236 -0.915 . . . . 0.0 109.523 -179.585 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_exo -54.2 -29.14 55.18 Favored 'Trans proline' 0 C--N 1.306 -1.705 0 C-N-CA 122.885 2.39 . . . . 0.0 112.204 179.092 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.25 -24.53 66.6 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.334 -0.854 . . . . 0.0 109.502 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.571 ' CD1' ' N ' ' A' ' 13' ' ' LEU . 4.8 mp -96.1 155.84 37.76 Favored Pre-proline 0 N--CA 1.489 1.519 0 O-C-N 121.263 -0.898 . . . . 0.0 109.542 -179.841 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -59.34 143.8 99.61 Favored 'Trans proline' 0 C--N 1.305 -1.719 0 C-N-CA 122.799 2.333 . . . . 0.0 112.182 179.273 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 70.5 tp60 -47.81 129.44 14.2 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.278 -0.889 . . . . 0.0 109.491 179.601 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 119.24 -21.9 9.16 Favored Glycine 0 N--CA 1.489 2.214 0 N-CA-C 109.576 -1.409 . . . . 0.0 109.576 -179.317 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . 0.41 ' N ' ' CD1' ' A' ' 17' ' ' TRP . 15.9 m95 -83.73 151.35 25.28 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.219 -1.165 . . . . 0.0 109.456 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -128.94 146.05 51.06 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.239 -0.913 . . . . 0.0 109.472 -179.394 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 77.8 ttt-85 -127.86 123.87 36.12 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.242 -0.911 . . . . 0.0 109.478 178.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.543 ' OE1' ' CZ ' ' A' ' 7' ' ' ARG . 7.2 pt-20 -131.37 138.92 49.35 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.254 -0.903 . . . . 0.0 109.529 -179.834 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 46.0 tt0 -94.39 143.95 25.97 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.333 -0.854 . . . . 0.0 109.423 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 47.3 t -126.5 135.56 27.41 Favored Pre-proline 0 N--CA 1.49 1.552 0 O-C-N 121.206 -0.933 . . . . 0.0 109.606 -179.257 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -65.58 152.21 82.47 Favored 'Trans proline' 0 C--N 1.304 -1.772 0 C-N-CA 122.828 2.352 . . . . 0.0 112.214 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.511 ' CZ ' ' O ' ' A' ' 24' ' ' ARG . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.589 0 O-C-N 121.258 -0.901 . . . . 0.0 109.504 -178.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 74.0 m80 . . . . . 0 N--CA 1.49 1.552 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 84.8 mtt85 -111.62 128.05 55.93 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.228 -0.92 . . . . 0.0 109.461 179.818 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 97.1 m-20 -91.37 140.28 29.92 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.135 -0.978 . . . . 0.0 109.461 -179.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 21.5 t -106.08 132.85 52.13 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.272 -0.893 . . . . 0.0 109.436 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.57 ' CD1' ' NZ ' ' A' ' 44' ' ' LYS . 78.4 m-85 -120.96 142.23 49.94 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.299 -0.876 . . . . 0.0 109.444 179.634 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -112.31 146.36 38.39 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.299 -0.876 . . . . 0.0 109.536 -179.642 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 87.7 m-85 -126.49 139.98 52.81 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.176 -0.953 . . . . 0.0 109.529 179.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.686 ' HG ' ' N ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -100.44 165.18 14.87 Favored Pre-proline 0 N--CA 1.489 1.502 0 O-C-N 121.223 -0.923 . . . . 0.0 109.418 179.644 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.686 ' N ' ' HG ' ' A' ' 39' ' ' SER . 18.8 Cg_endo -58.81 -19.37 46.43 Favored 'Trans proline' 0 C--N 1.306 -1.685 0 C-N-CA 122.783 2.322 . . . . 0.0 112.258 179.705 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.483 ' H ' ' HG ' ' A' ' 39' ' ' SER . 3.0 p -89.98 -0.91 57.84 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.291 -0.88 . . . . 0.0 109.433 179.725 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 86.61 14.65 65.17 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.506 -1.438 . . . . 0.0 109.506 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -80.35 117.42 21.09 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.296 -1.12 . . . . 0.0 109.511 -179.633 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.57 ' NZ ' ' CD1' ' A' ' 36' ' ' PHE . 61.5 tttm -92.57 128.86 38.58 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.297 -0.877 . . . . 0.0 109.396 178.765 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.624 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 1.0 OUTLIER -139.71 147.25 40.66 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.222 -0.924 . . . . 0.0 109.457 -179.716 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.623 ' NE ' ' O ' ' A' ' 46' ' ' ARG . 0.6 OUTLIER -137.36 62.12 1.6 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.161 -0.962 . . . . 0.0 109.53 179.635 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -150.14 133.34 16.31 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.306 -0.871 . . . . 0.0 109.433 179.871 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.599 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 1.1 tmtp? -55.42 -46.79 99.65 Favored Pre-proline 0 N--CA 1.491 1.59 0 O-C-N 121.238 -0.913 . . . . 0.0 109.437 -179.599 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.599 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 51.8 Cg_exo -53.7 -35.28 77.56 Favored 'Trans proline' 0 C--N 1.306 -1.685 0 C-N-CA 122.813 2.342 . . . . 0.0 112.234 -179.799 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.581 ' OE1' ' NH2' ' A' ' 53' ' ' ARG . 3.6 mm100 -67.09 -36.85 82.86 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.246 -0.909 . . . . 0.0 109.554 179.821 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.475 ' CD2' ' N ' ' A' ' 51' ' ' LEU . 3.8 mm? -66.4 -53.9 30.56 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.153 -0.967 . . . . 0.0 109.457 -179.046 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.617 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -66.97 -47.7 70.77 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.331 -0.855 . . . . 0.0 109.511 -178.521 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.581 ' NH2' ' OE1' ' A' ' 50' ' ' GLN . 57.3 ttp180 -59.21 -45.06 92.11 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.278 -0.889 . . . . 0.0 109.463 -178.839 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -69.7 -54.48 13.6 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.334 -0.854 . . . . 0.0 109.468 -179.211 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.457 ' O ' ' O ' ' A' ' 56' ' ' GLY . 1.8 mm? -80.42 -0.58 37.74 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.271 -0.893 . . . . 0.0 109.487 -179.462 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . 0.919 ' O ' ' N ' ' A' ' 58' ' ' SER . . . -51.39 -176.13 0.03 OUTLIER Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.514 -1.434 . . . . 0.0 109.514 179.641 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 43.9 -69.81 0.0 OUTLIER Glycine 0 N--CA 1.491 2.337 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.919 ' N ' ' O ' ' A' ' 56' ' ' GLY . 82.8 p -57.72 -30.89 65.91 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.29 -1.123 . . . . 0.0 109.441 -178.244 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.443 ' O ' ' O ' ' A' ' 55' ' ' LEU . 1.3 mmm -167.29 160.19 13.33 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.209 -0.932 . . . . 0.0 109.493 -179.419 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 45.2 t0 -109.59 129.08 55.61 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.201 -0.937 . . . . 0.0 109.441 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 94.4 mt -114.65 16.12 17.55 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.193 -0.942 . . . . 0.0 109.427 -179.173 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 12.0 t -58.03 -38.04 75.48 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.257 -0.902 . . . . 0.0 109.462 179.825 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 17.9 p -87.9 19.62 3.46 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.266 -0.896 . . . . 0.0 109.5 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 60.0 t80 -88.52 132.38 34.53 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.213 -0.929 . . . . 0.0 109.458 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.454 ' OD2' ' OG1' ' A' ' 68' ' ' THR . 60.1 t0 -83.43 111.51 19.1 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.356 -0.84 . . . . 0.0 109.454 -179.39 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 15.6 t80 -76.63 -39.93 50.85 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.256 -0.903 . . . . 0.0 109.517 -179.792 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.48 ' H ' ' NE ' ' A' ' 67' ' ' ARG . 0.2 OUTLIER -63.83 -42.29 97.65 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.182 -0.949 . . . . 0.0 109.575 -179.16 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' THR . . . . . 0.454 ' OG1' ' OD2' ' A' ' 65' ' ' ASP . 27.5 p -98.43 -12.47 21.34 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.317 -0.864 . . . . 0.0 109.591 -179.359 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . 0.45 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 63.21 39.87 98.41 Favored Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.526 -1.43 . . . . 0.0 109.526 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.403 ' H ' ' HB3' ' A' ' 65' ' ' ASP . 68.6 mttm -140.3 157.76 45.07 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.154 -1.204 . . . . 0.0 109.453 -179.523 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 68.4 mtp -86.02 132.21 34.1 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.257 -0.902 . . . . 0.0 109.556 179.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 4.0 mm? . . . . . 0 N--CA 1.491 1.612 0 O-C-N 121.301 -0.874 . . . . 0.0 109.472 179.939 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.6 mtt85 . . . . . 0 N--CA 1.49 1.571 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.407 ' HB2' ' CZ2' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -121.84 113.64 19.93 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.318 -0.863 . . . . 0.0 109.441 -179.86 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.492 ' C ' ' CD ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -102.86 123.17 46.0 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.22 -0.925 . . . . 0.0 109.462 179.849 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.407 ' CZ2' ' HB2' ' A' ' 6' ' ' LYS . 7.7 m0 -125.76 175.21 7.78 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.284 -0.885 . . . . 0.0 109.458 179.844 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 31.2 tp10 -81.15 155.12 26.37 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.271 -0.893 . . . . 0.0 109.526 179.686 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.554 ' SG ' ' N ' ' A' ' 19' ' ' ARG . 3.4 m -114.3 100.51 52.95 Favored Pre-proline 0 N--CA 1.49 1.562 0 O-C-N 121.29 -0.881 . . . . 0.0 109.395 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -53.64 -38.04 84.01 Favored 'Trans proline' 0 C--N 1.305 -1.727 0 C-N-CA 122.879 2.386 . . . . 0.0 112.255 179.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.0 -39.5 78.43 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.225 -0.922 . . . . 0.0 109.529 -179.522 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.574 ' CD2' ' N ' ' A' ' 13' ' ' LEU . 2.5 mm? -91.63 155.78 43.53 Favored Pre-proline 0 N--CA 1.489 1.499 0 O-C-N 121.2 -0.937 . . . . 0.0 109.546 179.896 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -55.59 160.27 9.62 Favored 'Trans proline' 0 C--N 1.303 -1.819 0 C-N-CA 122.905 2.403 . . . . 0.0 112.228 -179.591 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 59.3 tt0 -54.63 125.32 19.34 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.206 -0.934 . . . . 0.0 109.466 -179.166 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 125.23 -20.99 6.54 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.601 -1.4 . . . . 0.0 109.601 179.259 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 34.9 m95 -89.59 140.9 29.09 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.196 -1.179 . . . . 0.0 109.488 178.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.577 ' N ' ' OE1' ' A' ' 18' ' ' GLU . 54.5 mp0 -135.8 152.8 51.46 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.269 -0.895 . . . . 0.0 109.508 -179.09 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.554 ' N ' ' SG ' ' A' ' 10' ' ' CYS . 4.8 ptm85 -118.52 161.24 20.35 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.269 -0.894 . . . . 0.0 109.428 178.82 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 79.1 tt0 -143.05 137.43 29.22 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.208 -0.932 . . . . 0.0 109.5 -179.351 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -110.91 131.0 55.42 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.241 -0.912 . . . . 0.0 109.334 -179.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.9 t -136.1 123.27 14.5 Favored Pre-proline 0 N--CA 1.49 1.528 0 O-C-N 121.165 -0.959 . . . . 0.0 109.549 -179.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -75.76 135.51 17.8 Favored 'Trans proline' 0 C--N 1.304 -1.791 0 C-N-CA 122.816 2.344 . . . . 0.0 112.209 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 35.8 ttm180 . . . . . 0 N--CA 1.491 1.585 0 O-C-N 121.237 -0.914 . . . . 0.0 109.429 179.962 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 19.1 m170 . . . . . 0 N--CA 1.49 1.562 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 62.4 ttp180 -114.14 126.19 54.8 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.28 -0.888 . . . . 0.0 109.419 -179.642 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.505 ' OD1' ' O ' ' A' ' 34' ' ' ASP . 3.5 p30 -107.25 141.46 38.52 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.224 -0.923 . . . . 0.0 109.403 -179.827 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 35.1 t -114.89 131.91 65.68 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.143 -0.973 . . . . 0.0 109.426 -179.817 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -106.57 148.32 28.4 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.287 -0.883 . . . . 0.0 109.409 179.497 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.574 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 63.4 m-85 -116.1 147.18 41.58 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.302 -0.874 . . . . 0.0 109.439 -179.396 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -129.39 143.03 50.68 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.228 -0.92 . . . . 0.0 109.491 -179.446 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.429 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -97.88 176.57 1.98 Allowed Pre-proline 0 N--CA 1.491 1.575 0 O-C-N 121.347 -0.846 . . . . 0.0 109.428 179.784 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.429 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 48.6 Cg_exo -54.46 -28.53 54.83 Favored 'Trans proline' 0 C--N 1.305 -1.74 0 C-N-CA 122.888 2.392 . . . . 0.0 112.227 179.632 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 95.0 p -89.67 0.68 56.8 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.241 -0.912 . . . . 0.0 109.475 179.781 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 83.91 17.75 64.77 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 -179.681 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 61.0 tttp -70.5 122.58 19.95 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.25 -1.147 . . . . 0.0 109.479 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 63.7 tttm -92.39 125.83 37.22 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.222 -0.924 . . . . 0.0 109.531 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.492 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 3.3 p90 -140.32 146.99 39.2 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.225 -0.922 . . . . 0.0 109.466 -179.693 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.418 HH11 ' HD2' ' A' ' 46' ' ' ARG . 6.3 ptm85 -139.31 59.28 1.61 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.359 -0.838 . . . . 0.0 109.433 179.138 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.3 m -152.38 131.84 12.96 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.188 -0.945 . . . . 0.0 109.52 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.614 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 3.2 tmtp? -61.2 -45.39 95.54 Favored Pre-proline 0 N--CA 1.489 1.505 0 O-C-N 121.221 -0.924 . . . . 0.0 109.413 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.614 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 42.7 Cg_exo -55.69 -43.39 58.04 Favored 'Trans proline' 0 C--N 1.305 -1.747 0 C-N-CA 122.807 2.338 . . . . 0.0 112.224 179.58 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -65.02 -36.46 84.46 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.229 -0.919 . . . . 0.0 109.542 179.408 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 15.1 mt -62.11 -44.29 96.97 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.32 -0.863 . . . . 0.0 109.491 -179.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.708 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -77.2 -46.61 22.71 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.223 -0.923 . . . . 0.0 109.502 -179.865 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 14.1 tpp180 -54.15 -26.57 28.42 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.152 -0.967 . . . . 0.0 109.505 -179.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 68.1 t80 -97.59 -53.39 3.45 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.295 -0.878 . . . . 0.0 109.519 -179.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.467 ' C ' ' H ' ' A' ' 57' ' ' GLY . 3.4 tp -106.93 -4.6 18.94 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.197 -0.939 . . . . 0.0 109.497 -178.005 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . 0.708 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -61.61 -2.38 3.32 Favored Glycine 0 N--CA 1.489 2.213 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 -179.789 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . 0.467 ' H ' ' C ' ' A' ' 55' ' ' LEU . . . -99.17 -52.18 1.27 Allowed Glycine 0 N--CA 1.491 2.318 0 N-CA-C 109.526 -1.429 . . . . 0.0 109.526 -179.842 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 9.3 m -77.86 -10.43 59.56 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.265 -1.138 . . . . 0.0 109.524 179.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 52.1 ttm -159.19 152.07 21.94 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.222 -0.924 . . . . 0.0 109.483 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.477 ' OD1' ' OG ' ' A' ' 62' ' ' SER . 59.6 t0 -91.27 110.82 22.12 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.253 -0.904 . . . . 0.0 109.476 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.544 ' CD2' ' N ' ' A' ' 61' ' ' LEU . 3.8 mm? -93.72 -1.07 55.62 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.334 -0.854 . . . . 0.0 109.445 -179.929 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.477 ' OG ' ' OD1' ' A' ' 60' ' ' ASP . 94.1 p -57.63 -37.47 73.37 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.265 -0.897 . . . . 0.0 109.55 179.609 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 48.3 p -91.75 10.15 29.59 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.196 -0.94 . . . . 0.0 109.549 -179.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.462 ' O ' ' NZ ' ' A' ' 48' ' ' LYS . 49.9 t80 -87.51 132.7 33.94 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.204 -0.935 . . . . 0.0 109.487 -179.905 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.478 ' CG ' ' OG1' ' A' ' 68' ' ' THR . 55.3 t0 -85.49 110.81 19.45 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.298 -0.876 . . . . 0.0 109.543 -179.835 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.574 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 81.7 t80 -77.2 -41.32 41.85 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.269 -0.895 . . . . 0.0 109.482 -179.402 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 16.5 tpp180 -63.19 -42.53 99.35 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.265 -0.897 . . . . 0.0 109.501 -179.177 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' THR . . . . . 0.478 ' OG1' ' CG ' ' A' ' 65' ' ' ASP . 25.5 p -96.22 -13.4 23.48 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.297 -0.877 . . . . 0.0 109.473 -179.529 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . 0.415 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 62.54 41.87 99.75 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.415 -1.474 . . . . 0.0 109.415 179.731 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -134.54 147.87 50.39 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.222 -1.164 . . . . 0.0 109.43 -179.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 34.2 ttm -89.86 125.17 35.23 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.217 -0.927 . . . . 0.0 109.561 -179.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 2.3 pp . . . . . 0 N--CA 1.489 1.52 0 O-C-N 121.223 -0.923 . . . . 0.0 109.519 179.833 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.533 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.621 ' NZ ' ' O ' ' A' ' 21' ' ' GLU . 0.3 OUTLIER -115.61 110.39 19.13 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.207 -0.933 . . . . 0.0 109.493 179.864 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 86.3 mtm180 -93.5 112.37 24.26 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.365 -0.834 . . . . 0.0 109.483 -179.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 11.9 m0 -105.26 160.16 15.32 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.267 -0.896 . . . . 0.0 109.376 179.355 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -77.2 139.4 39.88 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.179 -0.95 . . . . 0.0 109.455 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 2.4 t -106.12 102.49 40.09 Favored Pre-proline 0 N--CA 1.49 1.528 0 O-C-N 121.269 -0.894 . . . . 0.0 109.548 179.309 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -72.48 -13.26 27.6 Favored 'Trans proline' 0 C--N 1.304 -1.764 0 C-N-CA 122.838 2.359 . . . . 0.0 112.265 -178.521 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -82.65 -20.11 36.91 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.181 -0.949 . . . . 0.0 109.494 -179.682 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.567 ' CD2' ' N ' ' A' ' 13' ' ' LEU . 3.8 mm? -101.13 157.93 32.74 Favored Pre-proline 0 N--CA 1.49 1.55 0 O-C-N 121.222 -0.924 . . . . 0.0 109.465 -179.873 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -52.69 144.67 41.99 Favored 'Trans proline' 0 C--N 1.305 -1.742 0 C-N-CA 122.804 2.336 . . . . 0.0 112.188 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -47.19 123.33 5.33 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.281 -0.887 . . . . 0.0 109.445 -179.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 124.02 -21.77 6.9 Favored Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.647 -1.381 . . . . 0.0 109.647 179.67 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . 0.406 ' CZ3' ' CZ ' ' A' ' 45' ' ' PHE . 21.3 m95 -85.42 146.68 26.86 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.225 -1.162 . . . . 0.0 109.439 179.505 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -132.13 149.32 52.43 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.194 -0.941 . . . . 0.0 109.451 -179.554 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 77.7 ttt-85 -114.92 157.44 23.36 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.188 -0.945 . . . . 0.0 109.497 179.416 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -152.5 153.68 33.97 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.248 -0.908 . . . . 0.0 109.494 -179.092 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.621 ' O ' ' NZ ' ' A' ' 6' ' ' LYS . 79.2 tt0 -119.5 131.28 55.54 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.331 -0.856 . . . . 0.0 109.338 179.318 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.6 t -130.28 125.35 21.75 Favored Pre-proline 0 N--CA 1.489 1.517 0 O-C-N 121.218 -0.926 . . . . 0.0 109.6 -179.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -73.76 122.63 7.91 Favored 'Trans proline' 0 C--N 1.304 -1.81 0 C-N-CA 122.804 2.336 . . . . 0.0 112.156 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.595 0 O-C-N 121.199 -0.938 . . . . 0.0 109.473 -179.716 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 13.4 m170 . . . . . 0 N--CA 1.49 1.566 0 N-CA-C 109.406 -0.591 . . . . 0.0 109.406 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 38.2 mmm-85 -112.27 109.07 18.52 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.254 -0.904 . . . . 0.0 109.508 -179.395 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -94.22 141.13 28.91 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.193 -0.942 . . . . 0.0 109.39 179.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 49.0 t -107.32 132.11 55.65 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.282 -0.887 . . . . 0.0 109.4 -179.152 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 -122.4 145.88 47.86 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.208 -0.933 . . . . 0.0 109.469 178.598 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.672 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 63.6 m-85 -119.02 151.52 38.07 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.311 -0.868 . . . . 0.0 109.382 -179.275 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 47.3 m-85 -123.7 139.9 53.53 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.187 -0.946 . . . . 0.0 109.518 179.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.451 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -95.37 177.28 1.85 Allowed Pre-proline 0 N--CA 1.49 1.561 0 O-C-N 121.33 -0.856 . . . . 0.0 109.539 179.178 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.451 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 48.3 Cg_exo -54.33 -29.21 56.9 Favored 'Trans proline' 0 C--N 1.304 -1.763 0 C-N-CA 122.838 2.359 . . . . 0.0 112.116 179.92 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 20.9 t -90.46 -1.55 57.9 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.251 -0.906 . . . . 0.0 109.499 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 86.46 22.51 47.12 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 75.5 tttt -75.42 127.17 32.52 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.193 -1.181 . . . . 0.0 109.453 -179.721 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.424 ' O ' ' HG3' ' A' ' 44' ' ' LYS . 21.3 ptmt -93.0 124.79 37.22 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.247 -0.908 . . . . 0.0 109.477 179.382 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.51 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 3.6 p90 -141.87 150.53 41.69 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.207 -0.933 . . . . 0.0 109.439 179.803 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.553 ' CD ' ' N ' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -135.66 67.02 1.49 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.262 -0.899 . . . . 0.0 109.472 179.708 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.3 m -157.15 116.87 3.43 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.304 -0.873 . . . . 0.0 109.403 179.551 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.584 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -53.78 -46.84 98.25 Favored Pre-proline 0 N--CA 1.489 1.52 0 O-C-N 121.256 -0.902 . . . . 0.0 109.542 -178.933 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.584 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 52.2 Cg_exo -54.35 -39.13 88.51 Favored 'Trans proline' 0 C--N 1.305 -1.717 0 C-N-CA 122.805 2.336 . . . . 0.0 112.202 179.433 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -61.54 -36.3 80.19 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.297 -0.877 . . . . 0.0 109.448 179.369 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 11.2 mp -66.46 -42.58 87.35 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.255 -0.903 . . . . 0.0 109.437 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -66.89 -50.41 62.54 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.174 -0.954 . . . . 0.0 109.471 -179.563 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.424 HH22 ' HB2' ' A' ' 49' ' ' PRO . 96.1 mtm-85 -60.18 -44.88 94.71 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.209 -0.932 . . . . 0.0 109.542 -179.378 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 67.8 t80 -65.81 -55.21 18.31 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.201 -0.937 . . . . 0.0 109.466 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 96.5 mt -61.45 -42.01 98.1 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.21 -0.931 . . . . 0.0 109.504 -179.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 93.94 -146.53 18.18 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 109.561 -1.416 . . . . 0.0 109.561 179.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -98.16 27.38 19.54 Favored Glycine 0 N--CA 1.492 2.381 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 179.761 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 13.0 m -89.42 -25.8 21.33 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.261 -1.141 . . . . 0.0 109.485 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 97.5 mtp -143.45 134.29 25.33 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.273 -0.892 . . . . 0.0 109.412 179.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -97.94 116.39 30.05 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.284 -0.885 . . . . 0.0 109.461 179.274 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 97.1 mt -95.82 2.75 53.95 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.119 -0.988 . . . . 0.0 109.469 -179.556 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 69.0 m -50.76 -39.01 51.2 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.255 -0.903 . . . . 0.0 109.506 179.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 31.4 p -94.6 39.67 1.09 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.254 -0.904 . . . . 0.0 109.52 179.229 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 85.0 t80 -125.75 125.67 43.35 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.257 -0.902 . . . . 0.0 109.437 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.603 ' O ' ' N ' ' A' ' 69' ' ' GLY . 89.3 m-20 -76.71 107.66 9.18 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.168 -0.958 . . . . 0.0 109.524 -179.609 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.672 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 54.5 t80 -74.78 -48.88 23.05 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.174 -0.953 . . . . 0.0 109.51 -179.821 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 18.3 mmm180 -54.72 -42.26 71.32 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.276 -0.89 . . . . 0.0 109.564 179.666 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 6.7 p -98.09 -14.35 20.51 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.169 -0.957 . . . . 0.0 109.462 -179.748 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . 0.603 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 64.77 31.68 81.7 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 179.728 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -112.57 150.66 31.03 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.227 -1.16 . . . . 0.0 109.436 -179.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 11.9 tpp -93.86 123.97 37.56 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.197 -0.939 . . . . 0.0 109.484 179.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.465 ' C ' ' CD1' ' A' ' 72' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.573 0 O-C-N 121.135 -0.978 . . . . 0.0 109.458 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 31.0 ptt180 . . . . . 0 N--CA 1.49 1.537 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.5 mmtp -63.06 147.8 49.68 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.352 -0.843 . . . . 0.0 109.501 -179.291 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 73.6 ttp85 -149.97 138.93 21.02 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.234 -0.916 . . . . 0.0 109.472 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.57 ' CD1' ' N ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -167.33 142.2 3.9 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.22 -0.925 . . . . 0.0 109.463 -179.828 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -103.64 142.45 34.3 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.241 -0.912 . . . . 0.0 109.458 178.517 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.598 ' SG ' ' O ' ' A' ' 10' ' ' CYS . 0.8 OUTLIER -115.19 129.15 25.32 Favored Pre-proline 0 N--CA 1.49 1.568 0 O-C-N 121.311 -0.868 . . . . 0.0 109.461 -179.657 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -51.16 -24.26 14.59 Favored 'Trans proline' 0 C--N 1.305 -1.715 0 C-N-CA 122.901 2.401 . . . . 0.0 112.233 178.499 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.466 ' O ' ' SD ' ' A' ' 59' ' ' MET . . . -71.08 -16.44 62.58 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.196 -0.94 . . . . 0.0 109.496 -179.602 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.5 mp -102.01 148.95 36.08 Favored Pre-proline 0 N--CA 1.49 1.565 0 O-C-N 121.192 -0.943 . . . . 0.0 109.402 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . 0.463 ' HG2' ' CD1' ' A' ' 17' ' ' TRP . 37.3 Cg_endo -67.5 149.0 79.9 Favored 'Trans proline' 0 C--N 1.305 -1.726 0 C-N-CA 122.904 2.403 . . . . 0.0 112.17 179.876 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.618 ' O ' ' NE2' ' A' ' 15' ' ' GLN . 1.5 pm0 -54.44 125.98 21.65 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.294 -0.878 . . . . 0.0 109.506 -179.131 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 122.38 -29.12 5.58 Favored Glycine 0 N--CA 1.491 2.337 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 179.351 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . 0.603 ' CZ2' ' OG ' ' A' ' 39' ' ' SER . 17.0 m95 -89.23 155.42 19.41 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.213 -1.169 . . . . 0.0 109.452 179.363 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -149.63 164.54 34.89 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.142 -0.974 . . . . 0.0 109.429 -178.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.602 ' NH1' ' O ' ' A' ' 69' ' ' GLY . 13.0 mtm105 -132.69 131.99 41.89 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.245 -0.909 . . . . 0.0 109.476 178.772 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -136.48 141.54 43.49 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.175 -0.953 . . . . 0.0 109.562 -178.771 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.537 ' OE2' ' CZ ' ' A' ' 33' ' ' ARG . 80.4 tt0 -102.43 147.01 27.25 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.315 -0.866 . . . . 0.0 109.358 179.022 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.5 t -149.31 127.59 5.9 Favored Pre-proline 0 N--CA 1.49 1.535 0 O-C-N 121.184 -0.948 . . . . 0.0 109.65 -178.603 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -77.33 140.07 19.16 Favored 'Trans proline' 0 C--N 1.306 -1.707 0 C-N-CA 122.851 2.367 . . . . 0.0 112.167 178.629 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.573 ' NE ' ' OD1' ' A' ' 34' ' ' ASP . 99.2 mtt180 . . . . . 0 N--CA 1.49 1.527 0 O-C-N 121.186 -0.947 . . . . 0.0 109.534 179.526 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 . . . . . 0 N--CA 1.491 1.609 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.537 ' CZ ' ' OE2' ' A' ' 21' ' ' GLU . 83.7 mtp180 -120.25 136.72 54.56 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.256 -0.903 . . . . 0.0 109.415 -179.721 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.573 ' OD1' ' NE ' ' A' ' 24' ' ' ARG . 4.6 m-20 -122.74 143.5 49.78 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.239 -0.913 . . . . 0.0 109.419 -179.709 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 65.5 t -105.9 136.1 41.55 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 O-C-N 121.244 -0.91 . . . . 0.0 109.442 179.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -122.27 147.08 46.66 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.358 -0.838 . . . . 0.0 109.51 179.857 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.453 ' CB ' ' CE2' ' A' ' 45' ' ' PHE . 8.5 m-85 -112.71 139.32 48.42 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.251 -0.906 . . . . 0.0 109.455 -179.878 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 74.7 m-85 -114.33 128.44 56.35 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.221 -0.924 . . . . 0.0 109.575 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.603 ' OG ' ' CZ2' ' A' ' 17' ' ' TRP . 0.1 OUTLIER -97.61 177.28 1.69 Allowed Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.279 -0.888 . . . . 0.0 109.447 179.251 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.444 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 52.8 Cg_exo -53.76 -30.39 56.57 Favored 'Trans proline' 0 C--N 1.306 -1.677 0 C-N-CA 122.904 2.402 . . . . 0.0 112.24 179.402 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 96.4 p -87.52 4.97 41.42 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.317 -0.864 . . . . 0.0 109.461 179.56 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 74.9 12.86 82.94 Favored Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 179.755 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 5.4 ttmt -73.32 131.27 41.72 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.24 -1.153 . . . . 0.0 109.452 -179.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 16.9 pttp -94.7 130.05 41.36 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.247 -0.908 . . . . 0.0 109.447 179.195 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.668 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 0.7 OUTLIER -139.53 146.3 39.74 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.271 -0.893 . . . . 0.0 109.399 -179.918 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 46.0 ptt85 -139.88 53.07 1.68 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.367 -0.833 . . . . 0.0 109.506 -179.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.4 p -150.93 134.99 16.73 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.281 -0.887 . . . . 0.0 109.464 179.573 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.607 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 0.9 OUTLIER -58.42 -46.13 99.64 Favored Pre-proline 0 N--CA 1.49 1.563 0 O-C-N 121.216 -0.927 . . . . 0.0 109.461 179.887 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.607 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 52.2 Cg_exo -53.16 -43.23 58.92 Favored 'Trans proline' 0 C--N 1.305 -1.717 0 C-N-CA 122.836 2.357 . . . . 0.0 112.189 -179.655 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -68.19 -33.94 75.36 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.248 -0.907 . . . . 0.0 109.522 179.096 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.432 ' CD1' ' C ' ' A' ' 51' ' ' LEU . 0.3 OUTLIER -59.37 -49.68 76.88 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.246 -0.909 . . . . 0.0 109.488 179.65 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -71.77 -37.6 70.45 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.183 -0.948 . . . . 0.0 109.55 -179.566 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 42.3 ttm180 -56.22 -51.08 69.4 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.247 -0.908 . . . . 0.0 109.558 -179.336 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . 0.471 ' C ' ' H ' ' A' ' 56' ' ' GLY . 18.4 t80 -68.51 -50.03 55.17 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.368 -0.833 . . . . 0.0 109.503 -179.708 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.486 ' O ' ' OG ' ' A' ' 58' ' ' SER . 4.2 mm? -64.23 1.2 0.78 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.144 -0.972 . . . . 0.0 109.444 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . 0.548 ' O ' ' C ' ' A' ' 57' ' ' GLY . . . 51.91 64.0 4.31 Favored Glycine 0 N--CA 1.492 2.384 0 N-CA-C 109.46 -1.456 . . . . 0.0 109.46 179.794 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . 0.548 ' C ' ' O ' ' A' ' 56' ' ' GLY . . . 33.82 36.0 0.05 OUTLIER Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.556 -1.417 . . . . 0.0 109.556 -179.515 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.53 ' N ' ' O ' ' A' ' 56' ' ' GLY . 74.2 m -85.24 -0.58 55.1 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.21 -1.171 . . . . 0.0 109.486 179.746 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.466 ' SD ' ' O ' ' A' ' 12' ' ' ALA . 40.6 ttp -157.34 149.69 22.86 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.351 -0.843 . . . . 0.0 109.497 -179.869 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 91.1 m-20 -86.34 106.35 17.33 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.292 -0.88 . . . . 0.0 109.405 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.56 ' CD2' ' N ' ' A' ' 61' ' ' LEU . 3.7 mm? -89.61 -4.89 57.62 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.222 -0.924 . . . . 0.0 109.462 -179.933 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 37.9 m -58.49 -33.89 70.3 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.297 -0.877 . . . . 0.0 109.532 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 17.9 p -96.45 9.22 42.01 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.178 -0.951 . . . . 0.0 109.48 -179.82 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 89.7 t80 -90.24 135.12 33.87 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.225 -0.922 . . . . 0.0 109.419 179.807 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.515 ' O ' ' N ' ' A' ' 69' ' ' GLY . 9.8 m-20 -85.67 111.29 19.95 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.248 -0.908 . . . . 0.0 109.582 179.818 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 77.4 t80 -75.16 -47.64 27.45 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.211 -0.931 . . . . 0.0 109.392 -179.286 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.417 ' HA ' ' HE ' ' A' ' 67' ' ' ARG . 0.3 OUTLIER -56.4 -43.84 79.7 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.251 -0.906 . . . . 0.0 109.474 -179.351 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 30.0 p -94.51 -15.38 24.21 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.165 -0.959 . . . . 0.0 109.515 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . 0.602 ' O ' ' NH1' ' A' ' 19' ' ' ARG . . . 63.69 35.68 92.35 Favored Glycine 0 N--CA 1.49 2.239 0 N-CA-C 109.568 -1.413 . . . . 0.0 109.568 179.797 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 54.8 mtpt -125.61 151.35 46.6 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.329 -1.101 . . . . 0.0 109.529 -179.543 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 10.8 tpp -93.54 121.78 35.3 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.257 -0.902 . . . . 0.0 109.405 179.812 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 56.4 tp . . . . . 0 N--CA 1.49 1.559 0 O-C-N 121.179 -0.951 . . . . 0.0 109.416 179.876 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.528 4.789 0 N-CA-C 119.407 2.523 . . . . 0.0 119.407 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.491 ' O ' ' C ' ' A' ' 3' ' ' MET . 11.2 p -84.54 151.76 24.35 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.279 -1.13 . . . . 0.0 109.482 -179.738 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.491 ' C ' ' O ' ' A' ' 2' ' ' SER . 65.9 mtt 40.05 61.92 1.39 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.243 -0.911 . . . . 0.0 109.488 179.645 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 79.6 mt-10 -70.82 130.84 42.74 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.266 -0.896 . . . . 0.0 109.528 179.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 33.8 ptt180 -127.15 135.89 51.33 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.275 -0.891 . . . . 0.0 109.47 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 12.6 mttp -85.26 169.89 13.35 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.25 -0.907 . . . . 0.0 109.539 179.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.547 ' NH1' ' OE2' ' A' ' 20' ' ' GLU . 61.8 ttt85 -155.87 95.04 1.6 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.207 -0.933 . . . . 0.0 109.441 -178.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 7.7 m0 -111.24 139.41 46.64 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.247 -0.908 . . . . 0.0 109.475 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -83.43 149.67 26.53 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.276 -0.89 . . . . 0.0 109.467 179.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 34.3 m -114.75 100.46 53.39 Favored Pre-proline 0 N--CA 1.491 1.587 0 O-C-N 121.203 -0.935 . . . . 0.0 109.492 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -55.56 -27.21 58.75 Favored 'Trans proline' 0 C--N 1.305 -1.748 0 C-N-CA 122.877 2.385 . . . . 0.0 112.272 178.3 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.41 -34.48 74.01 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.257 -0.902 . . . . 0.0 109.474 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.4 mt -90.15 157.46 45.37 Favored Pre-proline 0 N--CA 1.489 1.524 0 O-C-N 121.18 -0.95 . . . . 0.0 109.376 -179.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_exo -54.8 145.26 62.08 Favored 'Trans proline' 0 C--N 1.305 -1.723 0 C-N-CA 122.848 2.365 . . . . 0.0 112.185 179.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 94.4 mm-40 -49.57 127.85 16.38 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.323 -0.861 . . . . 0.0 109.463 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 123.88 -18.35 7.55 Favored Glycine 0 N--CA 1.49 2.24 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . 0.405 ' CD1' ' N ' ' A' ' 17' ' ' TRP . 21.1 m95 -93.0 150.74 20.33 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.259 -1.142 . . . . 0.0 109.468 179.14 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.509 ' N ' ' OE1' ' A' ' 18' ' ' GLU . 59.4 mp0 -144.42 160.91 40.28 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.227 -0.92 . . . . 0.0 109.463 -179.474 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.517 ' NH1' ' N ' ' A' ' 69' ' ' GLY . 33.6 ttt180 -121.2 156.88 31.45 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.221 -0.924 . . . . 0.0 109.42 179.286 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.547 ' OE2' ' NH1' ' A' ' 7' ' ' ARG . 95.9 mt-10 -147.23 142.59 27.39 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.221 -0.924 . . . . 0.0 109.524 -179.662 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 80.2 tt0 -115.18 133.85 55.67 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.277 -0.889 . . . . 0.0 109.456 179.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.6 t -129.09 123.29 21.67 Favored Pre-proline 0 N--CA 1.491 1.589 0 O-C-N 121.272 -0.893 . . . . 0.0 109.538 -178.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -77.04 129.86 10.85 Favored 'Trans proline' 0 C--N 1.306 -1.701 0 C-N-CA 122.868 2.379 . . . . 0.0 112.145 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 23.3 mmm180 -80.33 158.17 26.16 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.185 -0.947 . . . . 0.0 109.424 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 82.3 mtp180 -152.54 35.2 0.5 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.252 -0.905 . . . . 0.0 109.518 -179.415 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.489 ' O ' ' C ' ' A' ' 27' ' ' GLY . 58.0 m -103.68 105.84 16.18 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.296 -0.878 . . . . 0.0 109.453 -179.151 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.489 ' C ' ' O ' ' A' ' 26' ' ' SER . . . 38.51 -128.61 1.8 Allowed Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.48 -1.448 . . . . 0.0 109.48 179.039 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.549 ' C ' ' H ' ' A' ' 30' ' ' ALA . 97.0 mt -63.7 -27.79 69.45 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.254 -1.145 . . . . 0.0 109.443 -179.027 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.464 ' N ' ' O ' ' A' ' 26' ' ' SER . 0.5 OUTLIER -69.73 16.38 0.06 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.234 -0.916 . . . . 0.0 109.536 -179.636 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.549 ' H ' ' C ' ' A' ' 28' ' ' LEU . . . -90.62 163.73 14.45 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.3 -0.875 . . . . 0.0 109.431 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 82.19 -38.38 2.58 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.56 -1.416 . . . . 0.0 109.56 179.641 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 -61.27 138.75 58.23 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.225 -1.162 . . . . 0.0 109.453 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 84.7 mtm-85 -115.64 127.61 55.32 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.246 -0.909 . . . . 0.0 109.556 -179.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.451 ' OD1' ' N ' ' A' ' 35' ' ' VAL . 62.8 t0 -106.12 142.55 35.63 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.229 -0.919 . . . . 0.0 109.417 -179.902 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.451 ' N ' ' OD1' ' A' ' 34' ' ' ASP . 46.9 t -111.03 129.4 66.36 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.246 -0.909 . . . . 0.0 109.413 -179.592 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -116.69 145.37 43.49 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.255 -0.903 . . . . 0.0 109.514 179.118 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.627 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 60.2 m-85 -115.05 149.8 36.91 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.273 -0.892 . . . . 0.0 109.472 179.638 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 94.9 m-85 -127.76 140.39 52.09 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.246 -0.909 . . . . 0.0 109.518 179.397 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.47 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -97.91 178.35 1.36 Allowed Pre-proline 0 N--CA 1.489 1.509 0 O-C-N 121.242 -0.911 . . . . 0.0 109.504 179.452 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.47 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 35.6 Cg_exo -56.6 -29.31 78.66 Favored 'Trans proline' 0 C--N 1.305 -1.727 0 C-N-CA 122.826 2.351 . . . . 0.0 112.206 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 91.4 p -87.39 -0.92 57.5 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.164 -0.96 . . . . 0.0 109.485 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 83.53 22.2 56.71 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -74.8 126.06 30.12 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.262 -1.14 . . . . 0.0 109.454 179.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -94.33 121.55 35.97 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.275 -0.89 . . . . 0.0 109.542 179.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.636 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 1.2 p90 -141.36 149.83 41.65 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.214 -0.929 . . . . 0.0 109.506 -179.874 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.93 68.62 1.42 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.256 -0.903 . . . . 0.0 109.464 179.247 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 44.9 m -151.06 130.71 13.09 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.279 -0.888 . . . . 0.0 109.466 179.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.742 ' N ' ' HD2' ' A' ' 49' ' ' PRO . 20.3 tttt -60.73 -53.92 59.61 Favored Pre-proline 0 N--CA 1.49 1.54 0 O-C-N 121.288 -0.882 . . . . 0.0 109.457 -179.517 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.742 ' HD2' ' N ' ' A' ' 48' ' ' LYS . 10.9 Cg_endo -52.99 -38.53 80.02 Favored 'Trans proline' 0 C--N 1.304 -1.766 0 C-N-CA 122.853 2.369 . . . . 0.0 112.203 -179.521 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -64.66 -36.95 85.91 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.205 -0.934 . . . . 0.0 109.521 178.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 4.1 mt -64.75 -44.53 89.8 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.284 -0.885 . . . . 0.0 109.429 179.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.696 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -73.79 -45.57 50.78 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.213 -0.929 . . . . 0.0 109.485 -179.219 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -60.88 -44.52 96.97 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.265 -0.897 . . . . 0.0 109.489 -179.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 29.0 t80 -66.8 -54.17 25.38 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.312 -0.868 . . . . 0.0 109.492 -179.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 94.6 mt -91.84 10.58 28.02 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.224 -0.923 . . . . 0.0 109.479 -179.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.696 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -49.61 -71.08 0.66 Allowed Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 -179.63 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -54.07 -44.06 73.25 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 109.568 -1.413 . . . . 0.0 109.568 -179.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.425 ' HG ' ' CG ' ' A' ' 59' ' ' MET . 95.8 p -59.36 -29.66 67.84 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.231 -1.158 . . . . 0.0 109.463 -179.666 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.494 ' O ' ' O ' ' A' ' 56' ' ' GLY . 0.0 OUTLIER 179.5 173.38 0.86 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.229 -0.919 . . . . 0.0 109.479 -179.856 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 90.6 m-20 -102.24 123.48 46.15 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.287 -0.883 . . . . 0.0 109.477 179.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 98.6 mt -116.88 13.69 15.03 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.236 -0.915 . . . . 0.0 109.483 -179.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 92.9 p -56.11 -33.9 65.55 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.27 -0.894 . . . . 0.0 109.475 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 21.5 p -92.88 19.77 7.32 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.218 -0.926 . . . . 0.0 109.519 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -88.57 135.6 33.41 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.204 -0.935 . . . . 0.0 109.445 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.518 ' O ' ' N ' ' A' ' 69' ' ' GLY . 51.8 t0 -87.38 111.56 21.22 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.192 -0.943 . . . . 0.0 109.481 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.627 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 74.6 t80 -75.91 -41.68 51.15 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.227 -0.92 . . . . 0.0 109.527 -179.323 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.405 ' HD2' ' N ' ' A' ' 67' ' ' ARG . 3.2 mpt_? -62.12 -39.51 92.78 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.199 -0.938 . . . . 0.0 109.494 -179.046 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.458 ' OG1' ' CG ' ' A' ' 65' ' ' ASP . 44.0 p -103.05 -13.41 16.85 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.309 -0.869 . . . . 0.0 109.471 -178.447 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.518 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 62.79 42.37 99.69 Favored Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.4 ' H ' ' HB3' ' A' ' 65' ' ' ASP . 68.6 mttm -132.71 154.5 50.12 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.227 -1.161 . . . . 0.0 109.488 -179.775 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 57.0 ttm -91.61 125.13 36.23 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.291 -0.881 . . . . 0.0 109.514 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 8.6 tp . . . . . 0 N--CA 1.489 1.525 0 O-C-N 121.259 -0.901 . . . . 0.0 109.479 179.85 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.457 ' H3 ' ' NH2' ' A' ' 25' ' ' ARG . . . . . . . . 1 N--CA 1.528 4.796 0 N-CA-C 119.461 2.544 . . . . 0.0 119.461 . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 42.3 t -72.38 133.2 44.8 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.225 -1.162 . . . . 0.0 109.529 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 5.5 ttt -106.8 119.2 38.7 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.268 -0.895 . . . . 0.0 109.487 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -145.92 80.83 1.59 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.224 -0.923 . . . . 0.0 109.531 179.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 85.0 mtp180 -106.05 113.71 27.42 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.253 -0.905 . . . . 0.0 109.479 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.43 ' O ' ' HA ' ' A' ' 20' ' ' GLU . 0.5 OUTLIER -111.14 106.18 15.13 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.264 -0.897 . . . . 0.0 109.53 179.917 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 56.0 ttp180 -102.13 118.12 36.22 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.181 -0.95 . . . . 0.0 109.34 -179.466 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.559 ' CD1' ' N ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -124.99 144.56 50.32 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.221 -0.924 . . . . 0.0 109.429 179.603 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -57.43 141.27 47.97 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.207 -0.933 . . . . 0.0 109.443 -179.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.5 ' SG ' ' C ' ' A' ' 17' ' ' TRP . 0.8 OUTLIER -96.64 123.03 55.52 Favored Pre-proline 0 N--CA 1.491 1.588 0 O-C-N 121.254 -0.904 . . . . 0.0 109.51 179.72 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -73.75 -32.87 7.02 Favored 'Trans proline' 0 C--N 1.304 -1.771 0 C-N-CA 122.88 2.387 . . . . 0.0 112.249 -178.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.0 -38.02 85.26 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.337 -0.852 . . . . 0.0 109.516 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.578 ' CD1' ' N ' ' A' ' 13' ' ' LEU . 5.1 mp -84.01 156.59 63.8 Favored Pre-proline 0 N--CA 1.49 1.566 0 O-C-N 121.277 -0.889 . . . . 0.0 109.52 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -49.72 155.75 3.63 Favored 'Trans proline' 0 C--N 1.306 -1.699 0 C-N-CA 122.774 2.316 . . . . 0.0 112.284 179.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -56.29 123.73 15.61 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.19 -0.944 . . . . 0.0 109.468 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 123.26 -33.99 3.82 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 179.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . 0.5 ' C ' ' SG ' ' A' ' 10' ' ' CYS . 49.8 m95 -71.31 149.59 45.97 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.308 -1.113 . . . . 0.0 109.481 179.222 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 68.3 mt-10 -145.32 157.98 43.93 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.345 -0.847 . . . . 0.0 109.54 -178.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.426 ' NH1' ' O ' ' A' ' 68' ' ' THR . 21.1 ptt180 -141.59 145.62 35.28 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.3 -0.875 . . . . 0.0 109.432 179.046 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.43 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 19.2 pt-20 -130.39 143.3 50.68 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.226 -0.921 . . . . 0.0 109.584 -179.385 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -98.59 136.99 37.89 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.267 -0.896 . . . . 0.0 109.471 178.417 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 30.7 t -143.13 100.92 5.3 Favored Pre-proline 0 N--CA 1.49 1.575 0 O-C-N 121.23 -0.919 . . . . 0.0 109.529 -179.172 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_exo -56.69 136.51 76.58 Favored 'Trans proline' 0 C--N 1.305 -1.726 0 C-N-CA 122.872 2.382 . . . . 0.0 112.185 177.388 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 23.0 ptt180 -119.04 90.96 3.44 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.239 -0.913 . . . . 0.0 109.491 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.457 ' NH2' ' H3 ' ' A' ' 1' ' ' GLY . 52.7 ptt85 -92.87 20.21 6.85 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.27 -0.894 . . . . 0.0 109.428 178.756 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 32.8 m -134.14 113.86 12.51 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.16 -0.962 . . . . 0.0 109.456 -179.198 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 155.64 -168.01 33.2 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.595 -1.402 . . . . 0.0 109.595 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 94.3 mt -79.88 -50.2 10.82 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.257 -1.143 . . . . 0.0 109.473 179.355 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.501 ' O ' ' O ' ' A' ' 30' ' ' ALA . 65.2 p -96.77 24.26 6.25 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.301 -0.875 . . . . 0.0 109.442 178.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.501 ' O ' ' O ' ' A' ' 29' ' ' SER . . . -44.03 170.39 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.245 -0.909 . . . . 0.0 109.487 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 110.03 -31.12 7.72 Favored Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.591 -1.404 . . . . 0.0 109.591 -179.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 28.9 m170 -96.96 174.79 6.59 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.226 -1.161 . . . . 0.0 109.468 -179.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 50.5 ptt85 -118.35 137.53 53.03 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.351 -0.843 . . . . 0.0 109.465 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.409 ' OD1' ' N ' ' A' ' 35' ' ' VAL . 64.0 t0 -104.16 133.92 48.27 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.26 -0.9 . . . . 0.0 109.438 -179.495 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.409 ' N ' ' OD1' ' A' ' 34' ' ' ASP . 57.7 t -109.68 132.91 56.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 O-C-N 121.26 -0.9 . . . . 0.0 109.442 179.379 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -111.72 141.81 44.87 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.233 -0.917 . . . . 0.0 109.388 -179.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.541 ' CE1' ' CZ ' ' A' ' 66' ' ' PHE . 44.1 m-85 -114.81 143.25 45.38 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.25 -0.907 . . . . 0.0 109.475 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 87.8 m-85 -122.91 133.34 54.41 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.182 -0.949 . . . . 0.0 109.513 -179.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.472 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.4 OUTLIER -98.59 178.59 1.26 Allowed Pre-proline 0 N--CA 1.491 1.576 0 O-C-N 121.262 -0.899 . . . . 0.0 109.486 179.58 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.472 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 48.7 Cg_exo -54.6 -29.92 62.99 Favored 'Trans proline' 0 C--N 1.305 -1.752 0 C-N-CA 122.853 2.369 . . . . 0.0 112.206 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 96.4 p -85.89 7.82 22.65 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.272 -0.892 . . . . 0.0 109.485 179.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 72.71 8.59 72.76 Favored Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 -179.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 3.8 tmmt? -67.49 128.99 38.49 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.298 -1.119 . . . . 0.0 109.492 -179.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 51.9 pttt -99.14 130.34 45.45 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.262 -0.899 . . . . 0.0 109.451 179.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.491 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 9.8 p90 -141.69 149.19 40.24 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.306 -0.872 . . . . 0.0 109.479 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 25.7 ptt-85 -130.84 50.69 2.2 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.176 -0.952 . . . . 0.0 109.486 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -159.27 143.87 15.45 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.226 -0.921 . . . . 0.0 109.478 -179.888 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.633 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 10.6 tttt -60.14 -44.67 96.99 Favored Pre-proline 0 N--CA 1.489 1.501 0 O-C-N 121.205 -0.934 . . . . 0.0 109.515 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.633 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 47.3 Cg_exo -55.99 -38.69 94.33 Favored 'Trans proline' 0 C--N 1.305 -1.741 0 C-N-CA 122.855 2.37 . . . . 0.0 112.192 179.706 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 94.9 mm-40 -67.57 -37.97 83.4 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.259 -0.901 . . . . 0.0 109.482 179.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.46 ' CD1' ' CZ3' ' A' ' 17' ' ' TRP . 57.8 tp -61.04 -45.58 94.19 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.307 -0.871 . . . . 0.0 109.509 179.747 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.517 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -68.59 -40.37 80.51 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.241 -0.912 . . . . 0.0 109.392 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 77.7 ttt-85 -53.5 -44.65 69.25 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.328 -0.857 . . . . 0.0 109.478 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 50.5 t80 -66.31 -49.2 67.86 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.242 -0.911 . . . . 0.0 109.423 179.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.583 ' O ' ' N ' ' A' ' 57' ' ' GLY . 98.6 mt -80.75 4.87 17.5 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.25 -0.906 . . . . 0.0 109.454 179.753 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.517 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . 60.11 -74.6 0.01 OUTLIER Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.561 -1.416 . . . . 0.0 109.561 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . 0.583 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . 177.28 37.66 0.06 OUTLIER Glycine 0 N--CA 1.49 2.241 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 -179.712 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 87.1 p -93.34 8.32 40.91 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.23 -1.159 . . . . 0.0 109.45 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 99.7 mtp -145.87 139.83 26.59 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.23 -0.918 . . . . 0.0 109.5 -179.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.404 ' OD1' ' N ' ' A' ' 60' ' ' ASP . 38.4 p-10 -80.53 96.02 6.67 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.103 -0.998 . . . . 0.0 109.494 179.572 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 90.1 mt -95.41 -1.83 50.19 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.286 -0.884 . . . . 0.0 109.48 -179.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 35.8 t -53.96 -29.83 44.37 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.182 -0.949 . . . . 0.0 109.505 179.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 69.4 p -106.91 18.49 21.75 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.302 -0.874 . . . . 0.0 109.527 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.437 ' O ' ' CE ' ' A' ' 48' ' ' LYS . 14.8 t80 -88.22 124.73 34.14 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.215 -0.928 . . . . 0.0 109.51 -179.746 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.415 ' O ' ' N ' ' A' ' 69' ' ' GLY . 7.8 m-20 -79.92 113.57 18.18 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.302 -0.874 . . . . 0.0 109.451 -179.535 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.541 ' CZ ' ' CE1' ' A' ' 37' ' ' TYR . 58.5 t80 -79.24 -42.21 26.45 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.293 -0.879 . . . . 0.0 109.442 -179.791 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 83.7 mmt-85 -62.86 -40.17 96.67 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.199 -0.938 . . . . 0.0 109.453 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.426 ' O ' ' NH1' ' A' ' 19' ' ' ARG . 27.6 p -97.78 -13.62 21.26 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.335 -0.853 . . . . 0.0 109.472 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.415 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 61.62 40.41 98.71 Favored Glycine 0 N--CA 1.489 2.204 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 -179.844 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -128.67 149.7 50.56 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.172 -1.193 . . . . 0.0 109.437 -179.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 36.6 ttm -94.12 112.86 24.71 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.267 -0.896 . . . . 0.0 109.397 179.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.533 0 O-C-N 121.287 -0.883 . . . . 0.0 109.41 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.529 4.897 0 N-CA-C 119.447 2.539 . . . . 0.0 119.447 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.2 m 48.1 90.34 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.157 -1.202 . . . . 0.0 109.467 -179.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 6.5 ptp -60.84 136.68 58.15 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.245 -0.909 . . . . 0.0 109.41 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -103.99 152.75 21.64 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.275 -0.891 . . . . 0.0 109.428 -179.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.4 tpt180 60.87 75.15 0.42 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.336 -0.852 . . . . 0.0 109.459 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 31.1 mttt -79.4 169.69 17.7 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.291 -0.88 . . . . 0.0 109.462 -179.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.574 ' O ' ' CD1' ' A' ' 8' ' ' TRP . 79.0 mtp85 -143.66 135.12 26.08 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.324 -0.86 . . . . 0.0 109.455 -178.701 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.574 ' CD1' ' O ' ' A' ' 7' ' ' ARG . 6.3 m0 -157.85 129.09 6.63 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.207 -0.933 . . . . 0.0 109.438 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 45.8 tt0 -86.9 121.58 29.58 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.149 -0.97 . . . . 0.0 109.556 178.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.455 ' CA ' HH12 ' A' ' 19' ' ' ARG . 0.0 OUTLIER -79.61 123.85 83.97 Favored Pre-proline 0 N--CA 1.49 1.532 0 O-C-N 121.316 -0.865 . . . . 0.0 109.479 -179.444 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -71.8 -13.53 29.46 Favored 'Trans proline' 0 C--N 1.305 -1.721 0 C-N-CA 122.797 2.331 . . . . 0.0 112.235 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.452 ' O ' ' SD ' ' A' ' 59' ' ' MET . . . -82.64 -14.72 54.22 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.279 -0.888 . . . . 0.0 109.531 179.76 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.536 ' CD1' ' N ' ' A' ' 13' ' ' LEU . 5.8 mp -100.38 156.07 35.66 Favored Pre-proline 0 N--CA 1.49 1.571 0 O-C-N 121.161 -0.962 . . . . 0.0 109.428 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -57.1 142.09 94.27 Favored 'Trans proline' 0 C--N 1.305 -1.741 0 C-N-CA 122.911 2.407 . . . . 0.0 112.202 178.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -47.77 128.82 13.6 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.323 -0.86 . . . . 0.0 109.411 179.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 117.83 -17.79 11.82 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 -179.617 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 24.3 m95 -92.09 151.77 20.26 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.365 -1.079 . . . . 0.0 109.458 179.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -151.05 164.8 35.59 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.252 -0.905 . . . . 0.0 109.502 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.455 HH12 ' CA ' ' A' ' 10' ' ' CYS . 35.9 ptt-85 -142.7 149.13 38.41 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.29 -0.881 . . . . 0.0 109.509 179.331 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -124.51 162.94 22.93 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.26 -0.9 . . . . 0.0 109.509 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -117.54 135.66 53.79 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.302 -0.874 . . . . 0.0 109.388 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.4 t -131.32 115.2 16.15 Favored Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.261 -0.899 . . . . 0.0 109.546 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -76.58 142.02 22.81 Favored 'Trans proline' 0 C--N 1.304 -1.786 0 C-N-CA 122.91 2.407 . . . . 0.0 112.13 -179.262 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.453 ' HG3' ' HG ' ' A' ' 29' ' ' SER . 23.0 mmt180 -82.44 156.55 24.06 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.247 -0.908 . . . . 0.0 109.579 179.734 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.465 ' O ' ' O ' ' A' ' 26' ' ' SER . 43.1 ttm180 -120.23 124.3 45.35 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.303 -0.873 . . . . 0.0 109.495 -179.778 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.465 ' O ' ' O ' ' A' ' 25' ' ' ARG . 1.2 p 55.78 164.48 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.27 -0.894 . . . . 0.0 109.474 179.573 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.562 ' C ' ' H ' ' A' ' 29' ' ' SER . . . 98.89 155.0 28.95 Favored Glycine 0 N--CA 1.49 2.244 0 N-CA-C 109.487 -1.445 . . . . 0.0 109.487 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 11.1 mp -58.03 -0.51 0.08 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.205 -1.173 . . . . 0.0 109.462 179.306 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.562 ' H ' ' C ' ' A' ' 27' ' ' GLY . 3.8 t -104.09 29.01 6.24 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.262 -0.899 . . . . 0.0 109.499 -179.595 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.8 139.9 53.26 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.186 -0.946 . . . . 0.0 109.352 -179.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 84.69 -14.61 46.47 Favored Glycine 0 N--CA 1.49 2.256 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 179.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 31.6 m170 -78.42 122.13 25.42 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.329 -1.101 . . . . 0.0 109.426 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -108.78 111.94 23.96 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.316 -0.865 . . . . 0.0 109.495 -179.601 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 87.3 m-20 -84.69 139.3 32.11 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.285 -0.884 . . . . 0.0 109.433 179.086 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 42.6 t -113.82 128.74 70.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.298 -0.876 . . . . 0.0 109.453 -179.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.408 ' CE2' ' HD3' ' A' ' 46' ' ' ARG . 67.2 m-85 -105.62 142.81 34.71 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.324 -0.86 . . . . 0.0 109.437 179.608 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.552 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 68.4 m-85 -109.66 144.5 37.93 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.285 -0.884 . . . . 0.0 109.44 -179.406 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 -128.22 141.81 51.35 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.246 -0.909 . . . . 0.0 109.543 -179.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.461 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.4 OUTLIER -99.95 177.04 1.66 Allowed Pre-proline 0 N--CA 1.489 1.52 0 O-C-N 121.254 -0.904 . . . . 0.0 109.506 179.485 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.461 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 47.1 Cg_exo -55.45 -35.43 92.1 Favored 'Trans proline' 0 C--N 1.306 -1.704 0 C-N-CA 122.77 2.313 . . . . 0.0 112.31 -178.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 68.1 m -80.35 -4.4 53.31 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.206 -0.934 . . . . 0.0 109.482 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 89.42 16.0 57.78 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 179.722 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -66.75 122.15 17.02 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.262 -1.14 . . . . 0.0 109.471 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.403 ' CE ' ' CD2' ' A' ' 36' ' ' PHE . 87.4 tttt -93.99 123.03 37.09 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.267 -0.896 . . . . 0.0 109.472 179.306 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.609 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 1.6 p90 -140.92 148.37 40.32 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.335 -0.853 . . . . 0.0 109.418 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.408 ' HD3' ' CE2' ' A' ' 36' ' ' PHE . 65.7 ttp85 -134.07 65.46 1.57 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.184 -0.947 . . . . 0.0 109.508 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.9 m -150.12 130.28 13.6 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.231 -0.918 . . . . 0.0 109.452 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.726 ' N ' ' HD2' ' A' ' 49' ' ' PRO . 24.1 tttt -62.8 -54.08 50.43 Favored Pre-proline 0 N--CA 1.49 1.53 0 O-C-N 121.279 -0.888 . . . . 0.0 109.489 -179.857 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.726 ' HD2' ' N ' ' A' ' 48' ' ' LYS . 18.9 Cg_endo -57.65 -38.66 92.65 Favored 'Trans proline' 0 C--N 1.306 -1.692 0 C-N-CA 122.792 2.328 . . . . 0.0 112.198 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -65.39 -39.73 92.57 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.28 -0.887 . . . . 0.0 109.5 179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 5.1 tt -69.29 -41.15 77.2 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.26 -0.9 . . . . 0.0 109.536 179.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.576 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -62.62 -43.02 99.86 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.185 -0.947 . . . . 0.0 109.472 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.462 HH12 ' HB2' ' A' ' 49' ' ' PRO . 92.6 mtm-85 -59.45 -42.51 92.14 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.306 -0.871 . . . . 0.0 109.479 179.492 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -59.78 -50.23 74.63 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.396 -0.815 . . . . 0.0 109.508 179.127 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.423 ' N ' HD21 ' A' ' 55' ' ' LEU . 3.6 mm? -85.78 -0.13 54.43 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.186 -0.946 . . . . 0.0 109.491 178.383 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.576 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -61.87 97.6 0.16 Allowed Glycine 0 N--CA 1.492 2.367 0 N-CA-C 109.506 -1.438 . . . . 0.0 109.506 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 132.26 -63.98 0.62 Allowed Glycine 0 N--CA 1.489 2.226 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 76.2 p -69.88 -24.75 63.46 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.182 -1.187 . . . . 0.0 109.574 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.452 ' SD ' ' O ' ' A' ' 12' ' ' ALA . 55.1 ttm -159.3 149.5 19.13 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.229 -0.92 . . . . 0.0 109.475 -179.717 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 49.8 t0 -95.16 117.04 29.54 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.235 -0.916 . . . . 0.0 109.45 179.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 10.7 mp -113.44 10.23 18.24 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.336 -0.853 . . . . 0.0 109.433 -179.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 50.3 m -52.44 -37.28 56.54 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.234 -0.916 . . . . 0.0 109.463 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 17.9 p -92.62 18.83 8.11 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.188 -0.945 . . . . 0.0 109.485 179.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.41 ' CD1' ' CB ' ' A' ' 12' ' ' ALA . 70.0 t80 -90.99 132.58 35.9 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.19 -0.944 . . . . 0.0 109.387 179.628 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.503 ' O ' ' N ' ' A' ' 69' ' ' GLY . 60.7 t0 -82.63 112.65 19.71 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.205 -0.935 . . . . 0.0 109.563 179.911 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.552 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 73.7 t80 -75.17 -44.3 47.43 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.207 -0.933 . . . . 0.0 109.417 -179.23 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 13.7 tpt180 -58.06 -44.5 87.49 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.263 -0.898 . . . . 0.0 109.423 -179.118 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.452 ' OG1' ' CG ' ' A' ' 65' ' ' ASP . 49.7 p -97.13 -12.94 22.49 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.292 -0.88 . . . . 0.0 109.468 -179.288 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.503 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 61.65 40.86 99.32 Favored Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -130.77 156.24 45.3 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.314 -1.109 . . . . 0.0 109.453 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 5.4 ttm -94.98 120.43 35.18 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.267 -0.895 . . . . 0.0 109.492 179.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.442 ' C ' ' CD1' ' A' ' 72' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.573 0 O-C-N 121.269 -0.894 . . . . 0.0 109.424 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.529 4.841 0 N-CA-C 119.473 2.549 . . . . 0.0 119.473 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.463 ' OG ' ' N ' ' A' ' 3' ' ' MET . 71.2 p -125.47 -65.02 1.03 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.251 -1.146 . . . . 0.0 109.512 -179.803 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.463 ' N ' ' OG ' ' A' ' 2' ' ' SER . 77.8 mtm -84.92 135.63 33.97 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.229 -0.919 . . . . 0.0 109.417 -179.548 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -64.55 142.36 58.45 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.27 -0.894 . . . . 0.0 109.457 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.405 ' N ' ' HD2' ' A' ' 5' ' ' ARG . 11.7 mpt_? -51.73 178.65 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.189 -0.945 . . . . 0.0 109.398 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.58 96.84 7.63 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.263 -0.898 . . . . 0.0 109.529 -179.6 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.444 ' O ' ' CG ' ' A' ' 8' ' ' TRP . 99.3 mtt180 -71.81 167.59 19.65 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.254 -0.904 . . . . 0.0 109.5 179.604 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.444 ' CG ' ' O ' ' A' ' 7' ' ' ARG . 0.8 OUTLIER -166.21 144.66 5.66 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.17 -0.956 . . . . 0.0 109.514 -179.716 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.465 ' N ' ' OE1' ' A' ' 9' ' ' GLU . 58.7 mp0 -92.56 137.05 32.7 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.25 -0.906 . . . . 0.0 109.454 179.73 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.539 ' SG ' ' O ' ' A' ' 69' ' ' GLY . 0.5 OUTLIER -115.11 101.44 54.49 Favored Pre-proline 0 N--CA 1.49 1.529 0 O-C-N 121.301 -0.874 . . . . 0.0 109.567 -179.831 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -51.3 -37.79 60.83 Favored 'Trans proline' 0 C--N 1.306 -1.683 0 C-N-CA 122.872 2.381 . . . . 0.0 112.208 179.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.94 -24.3 64.25 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.213 -0.929 . . . . 0.0 109.511 179.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 7.2 mp -87.41 157.13 53.43 Favored Pre-proline 0 N--CA 1.49 1.554 0 O-C-N 121.324 -0.86 . . . . 0.0 109.542 179.491 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.451 ' HG2' ' CD1' ' A' ' 17' ' ' TRP . 18.0 Cg_endo -59.8 140.76 94.79 Favored 'Trans proline' 0 C--N 1.305 -1.742 0 C-N-CA 122.802 2.334 . . . . 0.0 112.172 -179.694 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -53.18 121.49 7.61 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.279 -0.888 . . . . 0.0 109.524 -179.175 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 122.6 -27.48 5.98 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 179.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . 0.456 ' CZ3' ' CZ ' ' A' ' 45' ' ' PHE . 11.5 m95 -83.69 154.45 23.65 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.343 -1.093 . . . . 0.0 109.553 179.728 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -143.68 157.94 44.03 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.325 -0.86 . . . . 0.0 109.455 -179.436 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.57 ' NH1' ' O ' ' A' ' 69' ' ' GLY . 33.8 ptt180 -124.42 163.56 21.53 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.244 -0.91 . . . . 0.0 109.485 179.777 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -141.8 140.92 33.13 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.284 -0.885 . . . . 0.0 109.571 -179.172 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 28.5 tp10 -101.89 122.36 43.86 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.317 -0.865 . . . . 0.0 109.438 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.5 t -118.25 98.47 51.41 Favored Pre-proline 0 N--CA 1.49 1.529 0 O-C-N 121.17 -0.956 . . . . 0.0 109.639 -179.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -58.58 128.04 26.8 Favored 'Trans proline' 0 C--N 1.305 -1.712 0 C-N-CA 122.851 2.367 . . . . 0.0 112.184 179.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.414 ' NE ' ' HB2' ' A' ' 34' ' ' ASP . 99.5 mtt180 -90.31 164.19 14.45 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.148 -0.97 . . . . 0.0 109.462 178.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 89.7 mtm180 -136.75 25.3 3.09 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.362 -0.836 . . . . 0.0 109.418 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.92 178.6 4.81 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.312 -0.868 . . . . 0.0 109.51 -179.837 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -68.8 -84.23 0.14 Allowed Glycine 0 N--CA 1.489 2.227 0 N-CA-C 109.489 -1.444 . . . . 0.0 109.489 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.511 ' CD2' ' N ' ' A' ' 28' ' ' LEU . 3.8 mm? -61.95 -38.71 89.53 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.162 -1.199 . . . . 0.0 109.511 -179.454 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -76.08 22.55 0.15 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.204 -0.935 . . . . 0.0 109.432 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.494 ' H ' ' C ' ' A' ' 28' ' ' LEU . . . -71.26 142.62 50.53 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.109 -0.995 . . . . 0.0 109.432 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 77.16 -12.51 12.36 Favored Glycine 0 N--CA 1.492 2.389 0 N-CA-C 109.514 -1.434 . . . . 0.0 109.514 179.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . 0.4 ' H ' ' C ' ' A' ' 30' ' ' ALA . 73.6 m80 -75.73 130.46 38.71 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.221 -1.164 . . . . 0.0 109.475 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 94.9 mtt-85 -110.59 121.51 45.5 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.26 -0.9 . . . . 0.0 109.518 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.414 ' HB2' ' NE ' ' A' ' 24' ' ' ARG . 58.6 t0 -84.38 136.68 33.78 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.318 -0.864 . . . . 0.0 109.474 179.32 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 25.0 t -111.06 128.16 67.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.267 -0.896 . . . . 0.0 109.502 -179.128 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 52.9 m-85 -117.44 147.15 42.97 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.245 -0.909 . . . . 0.0 109.499 179.098 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 -117.8 148.96 41.58 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.195 -0.941 . . . . 0.0 109.363 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.425 ' CD1' ' N ' ' A' ' 38' ' ' TYR . 12.9 m-85 -133.21 144.59 49.9 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.216 -0.928 . . . . 0.0 109.579 -178.759 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.44 ' H ' ' HG ' ' A' ' 39' ' ' SER . 4.6 p -103.38 159.44 29.28 Favored Pre-proline 0 N--CA 1.491 1.584 0 O-C-N 121.24 -0.913 . . . . 0.0 109.474 179.051 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -54.01 -16.36 9.01 Favored 'Trans proline' 0 C--N 1.304 -1.779 0 C-N-CA 122.788 2.325 . . . . 0.0 112.271 178.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 4.5 m -86.15 -2.16 58.09 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.242 -0.911 . . . . 0.0 109.526 179.081 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 84.83 5.83 85.94 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 41.6 tttp -75.67 119.61 19.93 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.255 -1.144 . . . . 0.0 109.38 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -93.53 121.98 35.49 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.221 -0.924 . . . . 0.0 109.487 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.456 ' CZ ' ' CZ3' ' A' ' 17' ' ' TRP . 2.7 p90 -141.0 149.69 42.09 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.252 -0.905 . . . . 0.0 109.437 178.865 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.696 ' O ' ' C ' ' A' ' 47' ' ' SER . 70.8 ttp85 -124.58 -72.54 0.67 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.321 -0.862 . . . . 0.0 109.463 179.815 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.696 ' C ' ' O ' ' A' ' 46' ' ' ARG . 0.7 OUTLIER -21.26 130.41 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.321 -0.862 . . . . 0.0 109.503 179.664 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.656 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 4.8 tttm -65.74 -42.79 57.01 Favored Pre-proline 0 N--CA 1.491 1.584 0 O-C-N 121.171 -0.956 . . . . 0.0 109.498 179.866 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.656 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 49.8 Cg_exo -54.77 -49.62 16.12 Favored 'Trans proline' 0 C--N 1.306 -1.704 0 C-N-CA 122.831 2.354 . . . . 0.0 112.253 -179.521 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.417 ' CG ' ' N ' ' A' ' 51' ' ' LEU . 0.6 OUTLIER -68.01 -33.78 75.25 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.282 -0.886 . . . . 0.0 109.546 179.765 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.417 ' N ' ' CG ' ' A' ' 50' ' ' GLN . 6.9 tt -62.55 -43.88 97.73 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.281 -0.887 . . . . 0.0 109.46 179.68 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -69.84 -40.21 75.95 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.238 -0.914 . . . . 0.0 109.503 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 70.8 ttp85 -58.44 -44.15 89.04 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.291 -0.881 . . . . 0.0 109.535 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 42.8 t80 -59.54 -50.68 72.98 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.228 -0.92 . . . . 0.0 109.545 179.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 80.1 mt -58.12 -43.15 87.05 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.158 -0.964 . . . . 0.0 109.47 179.278 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.412 ' O ' ' C ' ' A' ' 57' ' ' GLY . . . 65.35 83.07 0.1 OUTLIER Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 179.086 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . 0.412 ' C ' ' O ' ' A' ' 56' ' ' GLY . . . 44.08 72.95 0.28 Allowed Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.515 -1.434 . . . . 0.0 109.515 179.058 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 6.9 m -119.5 -26.7 5.71 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.256 -1.144 . . . . 0.0 109.509 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -169.34 160.0 9.12 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.29 -0.881 . . . . 0.0 109.506 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 50.5 t0 -80.6 92.36 5.94 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.345 -0.847 . . . . 0.0 109.5 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 96.0 mt -100.98 -0.56 36.35 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.279 -0.888 . . . . 0.0 109.402 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 5.0 t -54.4 -30.84 53.49 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.268 -0.895 . . . . 0.0 109.522 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 76.0 p -92.27 11.49 25.63 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.225 -0.922 . . . . 0.0 109.437 179.723 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.41 ' CZ ' ' C ' ' A' ' 69' ' ' GLY . 74.3 t80 -86.89 131.78 34.01 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.27 -0.894 . . . . 0.0 109.519 -179.74 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.518 ' O ' ' N ' ' A' ' 69' ' ' GLY . 55.8 t0 -82.94 114.82 21.48 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.266 -0.896 . . . . 0.0 109.478 -179.629 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 24.2 t80 -75.18 -47.42 28.45 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.179 -0.95 . . . . 0.0 109.523 -179.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 7.7 mmt85 -55.22 -42.33 73.23 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.133 -0.98 . . . . 0.0 109.478 -179.002 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.404 ' OG1' ' CG ' ' A' ' 65' ' ' ASP . 33.2 p -98.69 -13.97 20.02 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.223 -0.923 . . . . 0.0 109.53 -179.455 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.57 ' O ' ' NH1' ' A' ' 19' ' ' ARG . . . 61.07 40.85 99.1 Favored Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 179.777 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -134.8 153.77 51.89 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.297 -1.12 . . . . 0.0 109.492 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 12.8 ttm -87.41 126.28 34.78 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.271 -0.893 . . . . 0.0 109.479 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 97.0 mt . . . . . 0 N--CA 1.489 1.506 0 O-C-N 121.239 -0.913 . . . . 0.0 109.501 179.899 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.528 4.817 0 N-CA-C 119.405 2.522 . . . . 0.0 119.405 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.6 p -73.14 162.52 29.33 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.262 -1.14 . . . . 0.0 109.552 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 77.3 mtm -83.73 63.16 7.31 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.224 -0.923 . . . . 0.0 109.436 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.486 ' O ' ' O ' ' A' ' 5' ' ' ARG . 17.4 pt-20 -87.43 154.53 20.58 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.257 -0.902 . . . . 0.0 109.432 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.486 ' O ' ' O ' ' A' ' 4' ' ' GLU . 61.0 ttp180 54.02 106.61 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.254 -0.904 . . . . 0.0 109.423 -179.685 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.4 mptt -120.9 113.96 20.87 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.25 -0.906 . . . . 0.0 109.447 179.766 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.448 ' CZ ' ' OE2' ' A' ' 18' ' ' GLU . 14.8 ttp180 -96.36 118.05 32.11 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.285 -0.884 . . . . 0.0 109.468 -179.548 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 5.1 m0 -106.43 156.26 18.72 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.3 -0.875 . . . . 0.0 109.502 179.464 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 84.9 tt0 -72.45 148.73 44.86 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.3 -0.875 . . . . 0.0 109.51 -179.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.592 ' SG ' ' CZ ' ' A' ' 19' ' ' ARG . 74.8 m -106.69 104.83 52.86 Favored Pre-proline 0 N--CA 1.49 1.559 0 O-C-N 121.244 -0.91 . . . . 0.0 109.473 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -76.56 -21.19 13.24 Favored 'Trans proline' 0 C--N 1.306 -1.671 0 C-N-CA 122.78 2.32 . . . . 0.0 112.241 -179.565 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -84.24 -34.91 23.76 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.225 -0.922 . . . . 0.0 109.498 179.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.618 ' CD1' ' N ' ' A' ' 13' ' ' LEU . 4.6 mp -82.6 156.48 68.13 Favored Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.215 -0.928 . . . . 0.0 109.435 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -51.64 140.26 46.24 Favored 'Trans proline' 0 C--N 1.305 -1.722 0 C-N-CA 122.827 2.352 . . . . 0.0 112.192 179.352 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.556 ' H ' ' NE2' ' A' ' 15' ' ' GLN . 4.0 mp0 -45.85 122.85 4.01 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.27 -0.894 . . . . 0.0 109.448 -179.836 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 123.25 -18.86 7.77 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.59 -1.404 . . . . 0.0 109.59 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 26.5 m95 -92.65 151.18 20.24 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.176 -1.191 . . . . 0.0 109.499 179.405 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.448 ' OE2' ' CZ ' ' A' ' 7' ' ' ARG . 71.3 mt-10 -148.89 162.51 39.71 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.181 -0.949 . . . . 0.0 109.487 -179.399 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.592 ' CZ ' ' SG ' ' A' ' 10' ' ' CYS . 10.9 ptp85 -140.04 146.11 38.57 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.298 -0.876 . . . . 0.0 109.492 179.58 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -139.13 146.71 40.98 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.203 -0.935 . . . . 0.0 109.471 -178.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -103.1 140.14 37.7 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.311 -0.868 . . . . 0.0 109.47 178.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.0 t -141.6 123.48 9.12 Favored Pre-proline 0 N--CA 1.491 1.598 0 O-C-N 121.227 -0.921 . . . . 0.0 109.584 -179.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -75.4 135.41 18.33 Favored 'Trans proline' 0 C--N 1.304 -1.767 0 C-N-CA 122.863 2.375 . . . . 0.0 112.153 178.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 18.6 ttm180 -65.27 146.3 55.12 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.176 -0.953 . . . . 0.0 109.527 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 91.8 mtm-85 -136.13 -29.91 0.98 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.224 -0.922 . . . . 0.0 109.503 -178.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 34.8 t -131.64 87.64 2.48 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.199 -0.938 . . . . 0.0 109.488 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -177.72 160.64 27.32 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.56 -1.416 . . . . 0.0 109.56 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.453 ' C ' ' H ' ' A' ' 30' ' ' ALA . 97.2 mt -64.66 -42.96 95.03 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.217 -1.166 . . . . 0.0 109.476 -179.642 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.518 ' O ' ' O ' ' A' ' 30' ' ' ALA . 2.0 m -70.76 6.9 1.28 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.251 -0.906 . . . . 0.0 109.48 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.518 ' O ' ' O ' ' A' ' 29' ' ' SER . . . -34.92 155.21 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.194 -0.941 . . . . 0.0 109.49 179.157 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 100.29 -37.54 3.52 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 -179.47 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 73.9 m80 -89.55 166.12 13.85 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.201 -1.176 . . . . 0.0 109.477 179.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 17.2 ptp180 -117.7 134.59 54.74 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.214 -0.929 . . . . 0.0 109.486 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -105.2 141.88 35.95 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.281 -0.887 . . . . 0.0 109.45 -179.057 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 43.6 t -109.76 135.71 47.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.236 -0.915 . . . . 0.0 109.414 179.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 55.3 m-85 -121.96 144.18 49.03 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.17 -0.956 . . . . 0.0 109.49 -179.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.582 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 54.6 m-85 -115.68 147.89 40.34 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.284 -0.885 . . . . 0.0 109.475 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 36.4 m-85 -127.25 141.04 51.82 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.297 -0.877 . . . . 0.0 109.456 -179.524 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.634 ' HG ' ' N ' ' A' ' 40' ' ' PRO . 0.4 OUTLIER -98.86 177.64 1.52 Allowed Pre-proline 0 N--CA 1.49 1.553 0 O-C-N 121.375 -0.828 . . . . 0.0 109.397 179.448 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.634 ' N ' ' HG ' ' A' ' 39' ' ' SER . 53.0 Cg_exo -54.36 -34.67 81.57 Favored 'Trans proline' 0 C--N 1.305 -1.726 0 C-N-CA 122.861 2.374 . . . . 0.0 112.322 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.439 ' H ' ' HG ' ' A' ' 39' ' ' SER . 46.6 t -85.8 1.16 50.8 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.298 -0.876 . . . . 0.0 109.468 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 85.41 15.86 65.5 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 81.9 tttt -66.52 121.54 15.57 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.189 -1.183 . . . . 0.0 109.514 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 62.4 tttm -92.77 124.85 37.07 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.206 -0.933 . . . . 0.0 109.506 179.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.553 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 2.3 p90 -139.88 146.12 38.89 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.264 -0.898 . . . . 0.0 109.455 -179.721 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 14.9 ptm180 -136.64 59.57 1.69 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.233 -0.917 . . . . 0.0 109.493 179.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.528 ' HG ' ' H ' ' A' ' 50' ' ' GLN . 3.7 p -153.35 137.65 16.6 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.324 -0.86 . . . . 0.0 109.476 179.563 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.607 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 0.9 OUTLIER -66.52 -46.23 58.34 Favored Pre-proline 0 N--CA 1.489 1.499 0 O-C-N 121.314 -0.866 . . . . 0.0 109.503 -179.298 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.607 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 44.3 Cg_exo -55.83 -48.88 17.71 Favored 'Trans proline' 0 C--N 1.305 -1.738 0 C-N-CA 122.855 2.37 . . . . 0.0 112.261 -178.817 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.528 ' H ' ' HG ' ' A' ' 47' ' ' SER . 17.6 tt0 -65.76 -37.42 86.29 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.229 -0.919 . . . . 0.0 109.502 -179.833 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 44.5 tp -65.75 -47.57 74.78 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.286 -0.883 . . . . 0.0 109.553 -179.31 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.648 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -67.01 -45.55 77.23 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.324 -0.86 . . . . 0.0 109.51 -179.58 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 62.6 ttp180 -60.68 -45.54 93.75 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.173 -0.954 . . . . 0.0 109.514 -179.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 25.5 t80 -63.08 -52.57 62.2 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.301 -0.874 . . . . 0.0 109.479 -179.066 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 98.0 mt -88.7 3.98 48.87 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.21 -0.931 . . . . 0.0 109.447 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.648 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -61.89 -39.66 97.81 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.49 -1.444 . . . . 0.0 109.49 -179.621 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -83.23 2.35 87.19 Favored Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.51 -1.436 . . . . 0.0 109.51 -179.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 79.3 p -119.13 -23.31 6.86 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.326 -1.103 . . . . 0.0 109.457 -179.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 8.3 ttm -176.49 168.99 2.68 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.29 -0.881 . . . . 0.0 109.459 -179.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 93.5 m-20 -96.39 114.57 26.26 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.226 -0.921 . . . . 0.0 109.5 179.382 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.56 ' CD2' ' N ' ' A' ' 61' ' ' LEU . 3.6 mm? -98.31 4.69 48.68 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.231 -0.918 . . . . 0.0 109.49 -179.404 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 77.5 p -58.03 -38.26 75.9 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.252 -0.905 . . . . 0.0 109.46 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 19.6 p -87.56 6.21 35.5 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.269 -0.894 . . . . 0.0 109.463 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.41 ' CZ ' ' HA2' ' A' ' 69' ' ' GLY . 55.6 t80 -91.88 122.88 34.82 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.22 -0.925 . . . . 0.0 109.448 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.451 ' O ' ' N ' ' A' ' 69' ' ' GLY . 97.5 m-20 -75.35 114.38 13.82 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.25 -0.906 . . . . 0.0 109.493 179.805 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.582 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 81.9 t80 -77.76 -41.03 38.98 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.227 -0.921 . . . . 0.0 109.497 -179.378 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -61.56 -45.12 95.5 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.198 -0.939 . . . . 0.0 109.459 -179.801 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 46.0 p -95.06 -15.53 23.37 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.229 -0.919 . . . . 0.0 109.499 -179.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.451 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 63.92 44.64 95.75 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.57 -1.412 . . . . 0.0 109.57 -179.683 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 64.8 mttp -142.22 158.27 43.92 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.224 -1.163 . . . . 0.0 109.444 -179.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 1.2 mmt -79.69 136.81 36.88 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.232 -0.917 . . . . 0.0 109.435 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 48.9 tp . . . . . 0 N--CA 1.489 1.496 0 O-C-N 121.177 -0.952 . . . . 0.0 109.499 -179.712 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.529 4.867 0 N-CA-C 119.443 2.537 . . . . 0.0 119.443 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 35.4 t -62.65 -43.4 98.91 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.211 -1.17 . . . . 0.0 109.471 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 2.2 tpp -129.91 80.24 1.95 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.204 -0.935 . . . . 0.0 109.444 -179.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -95.89 132.83 40.77 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.256 -0.903 . . . . 0.0 109.524 179.457 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 95.3 mtt-85 -89.92 128.54 36.23 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.288 -0.882 . . . . 0.0 109.424 -179.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 73.6 mttt -72.98 153.7 40.83 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.288 -0.883 . . . . 0.0 109.445 179.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.584 ' O ' ' CD1' ' A' ' 8' ' ' TRP . 51.4 ptt85 -149.37 140.88 23.36 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.181 -0.949 . . . . 0.0 109.506 -179.309 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.584 ' CD1' ' O ' ' A' ' 7' ' ' ARG . 7.0 m0 -147.95 129.16 14.67 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.264 -0.897 . . . . 0.0 109.513 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -99.63 127.36 45.73 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.306 -0.871 . . . . 0.0 109.458 179.523 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.414 ' HB3' ' HE ' ' A' ' 19' ' ' ARG . 4.7 t -103.47 134.79 19.56 Favored Pre-proline 0 N--CA 1.491 1.619 0 O-C-N 121.277 -0.89 . . . . 0.0 109.414 -179.629 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -69.54 -14.07 36.22 Favored 'Trans proline' 0 C--N 1.306 -1.696 0 C-N-CA 122.861 2.374 . . . . 0.0 112.194 -179.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.39 -34.68 74.88 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.174 -0.954 . . . . 0.0 109.462 179.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.639 ' N ' ' CD2' ' A' ' 13' ' ' LEU . 2.6 mm? -91.02 150.47 41.84 Favored Pre-proline 0 N--CA 1.489 1.523 0 O-C-N 121.18 -0.95 . . . . 0.0 109.437 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -63.94 156.98 55.2 Favored 'Trans proline' 0 C--N 1.305 -1.725 0 C-N-CA 122.748 2.298 . . . . 0.0 112.219 -179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 55.7 tt0 -53.29 128.02 26.72 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.227 -0.921 . . . . 0.0 109.451 -179.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 124.82 -23.64 6.21 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.589 -1.404 . . . . 0.0 109.589 179.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . 0.448 ' CH2' ' CD2' ' A' ' 55' ' ' LEU . 49.9 m95 -87.64 143.66 27.07 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.294 -1.121 . . . . 0.0 109.406 179.708 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -143.55 156.7 44.68 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.27 -0.894 . . . . 0.0 109.515 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.531 ' NH2' ' CD2' ' A' ' 13' ' ' LEU . 53.0 mtt-85 -129.38 129.44 44.75 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.292 -0.88 . . . . 0.0 109.447 179.038 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -134.04 140.43 46.66 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.273 -0.892 . . . . 0.0 109.515 -179.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -104.57 149.05 25.84 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.246 -0.909 . . . . 0.0 109.428 178.595 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 4.7 t -145.84 124.76 6.61 Favored Pre-proline 0 N--CA 1.491 1.625 0 O-C-N 121.209 -0.932 . . . . 0.0 109.598 -179.43 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -75.32 136.47 19.8 Favored 'Trans proline' 0 C--N 1.304 -1.784 0 C-N-CA 122.849 2.366 . . . . 0.0 112.133 179.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 6.4 tpt180 -62.92 147.02 51.61 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.248 -0.907 . . . . 0.0 109.496 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 73.1 ttt-85 -135.01 -33.82 0.9 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.276 -0.89 . . . . 0.0 109.519 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 76.4 p -136.52 104.34 5.54 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.23 -0.919 . . . . 0.0 109.486 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 173.32 172.33 38.72 Favored Glycine 0 N--CA 1.489 2.219 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 58.2 tp -63.78 -42.52 97.75 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.259 -1.142 . . . . 0.0 109.471 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.476 ' O ' ' C ' ' A' ' 30' ' ' ALA . 99.2 p -84.21 10.92 9.12 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.282 -0.886 . . . . 0.0 109.481 -179.515 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.476 ' C ' ' O ' ' A' ' 29' ' ' SER . . . -38.94 131.37 1.39 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.308 -0.87 . . . . 0.0 109.497 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 122.83 -40.3 2.05 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 80.4 m80 -81.66 174.56 11.26 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.341 -1.094 . . . . 0.0 109.451 179.425 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 88.0 mtm-85 -118.94 136.68 53.95 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.175 -0.953 . . . . 0.0 109.492 179.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 93.4 m-20 -116.61 141.31 48.36 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.278 -0.889 . . . . 0.0 109.444 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.6 t -105.19 132.79 51.16 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.26 -0.9 . . . . 0.0 109.435 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -120.76 143.3 48.88 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.223 -0.923 . . . . 0.0 109.51 179.621 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 50.6 m-85 -118.63 146.64 44.5 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.209 -0.932 . . . . 0.0 109.437 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -127.71 138.36 52.77 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.241 -0.912 . . . . 0.0 109.552 -179.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.498 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.4 OUTLIER -99.85 179.32 1.06 Allowed Pre-proline 0 N--CA 1.49 1.545 0 O-C-N 121.194 -0.941 . . . . 0.0 109.504 179.147 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.498 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 40.2 Cg_exo -56.43 -32.59 89.54 Favored 'Trans proline' 0 C--N 1.305 -1.76 0 C-N-CA 122.81 2.34 . . . . 0.0 112.289 -179.628 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 7.4 m -87.08 5.13 39.16 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.369 -0.832 . . . . 0.0 109.594 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 81.43 10.07 85.03 Favored Glycine 0 N--CA 1.49 2.234 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 64.9 tttp -62.89 119.43 9.37 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.238 -1.154 . . . . 0.0 109.492 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.97 123.33 39.52 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.217 -0.927 . . . . 0.0 109.429 179.045 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 41.8 p90 -141.02 147.05 38.05 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.239 -0.913 . . . . 0.0 109.493 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 44.7 ptt85 -130.6 56.05 1.79 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.253 -0.904 . . . . 0.0 109.51 179.499 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -159.33 146.77 17.19 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.193 -0.942 . . . . 0.0 109.522 -179.84 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.655 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 0.5 OUTLIER -68.87 -42.87 25.38 Favored Pre-proline 0 N--CA 1.49 1.562 0 O-C-N 121.207 -0.933 . . . . 0.0 109.504 -179.581 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.655 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 51.0 Cg_exo -55.01 -44.63 47.81 Favored 'Trans proline' 0 C--N 1.306 -1.686 0 C-N-CA 122.761 2.307 . . . . 0.0 112.231 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 18.2 mm100 -71.32 -37.0 71.79 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.229 -0.919 . . . . 0.0 109.445 179.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.4 ' C ' ' CD2' ' A' ' 51' ' ' LEU . 3.8 tt -63.44 -47.36 82.21 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.263 -0.898 . . . . 0.0 109.502 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -66.15 -41.91 89.74 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.182 -0.949 . . . . 0.0 109.497 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 77.7 ttt-85 -56.45 -45.39 80.86 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.223 -0.923 . . . . 0.0 109.511 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -66.24 -50.0 65.27 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.325 -0.86 . . . . 0.0 109.455 179.284 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.448 ' CD2' ' CH2' ' A' ' 17' ' ' TRP . 4.2 mm? -70.9 -3.32 18.62 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.199 -0.938 . . . . 0.0 109.415 179.704 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.711 ' O ' ' N ' ' A' ' 58' ' ' SER . . . -50.87 161.68 1.28 Allowed Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.534 -1.426 . . . . 0.0 109.534 179.771 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 59.38 -61.04 0.01 OUTLIER Glycine 0 N--CA 1.489 2.226 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 -179.529 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.711 ' N ' ' O ' ' A' ' 56' ' ' GLY . 80.7 p -60.88 -28.96 69.27 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.273 -1.133 . . . . 0.0 109.463 -178.761 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.429 ' CB ' ' O ' ' A' ' 58' ' ' SER . 2.8 mtp 169.45 126.88 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.219 -0.926 . . . . 0.0 109.452 -179.479 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.621 ' OD1' ' N ' ' A' ' 61' ' ' LEU . 62.0 t0 -70.62 151.74 44.66 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.313 -0.867 . . . . 0.0 109.424 179.312 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.621 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 3.7 mp -133.19 24.87 4.2 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.273 -0.892 . . . . 0.0 109.494 -179.04 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 58.0 m -52.61 -32.68 42.85 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.148 -0.97 . . . . 0.0 109.484 -179.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' THR . . . . . 0.509 ' O ' ' SD ' ' A' ' 71' ' ' MET . 19.8 p -94.71 35.14 1.26 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.227 -0.92 . . . . 0.0 109.481 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 93.1 t80 -99.05 129.06 45.3 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.259 -0.901 . . . . 0.0 109.455 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 91.7 m-20 -81.9 114.29 20.41 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.253 -0.904 . . . . 0.0 109.375 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -76.45 -41.13 48.47 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.305 -0.872 . . . . 0.0 109.476 -179.549 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 23.1 mmm180 -63.24 -36.34 83.35 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.312 -0.868 . . . . 0.0 109.444 -178.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 19.5 p -95.53 -16.04 22.45 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.299 -0.875 . . . . 0.0 109.476 -179.414 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 64.64 36.48 93.19 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.571 -1.412 . . . . 0.0 109.571 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.8 mtmp? -145.87 162.52 37.54 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.355 -1.085 . . . . 0.0 109.439 -179.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.509 ' SD ' ' O ' ' A' ' 63' ' ' THR . 9.6 tpp -80.84 128.33 33.54 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.235 -0.916 . . . . 0.0 109.534 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 3.5 tt . . . . . 0 N--CA 1.491 1.605 0 O-C-N 121.336 -0.852 . . . . 0.0 109.472 -179.763 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.53 4.962 0 N-CA-C 119.442 2.537 . . . . 0.0 119.442 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 50.24 93.32 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.312 -1.111 . . . . 0.0 109.519 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 97.4 mtp -83.03 131.77 35.16 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.182 -0.949 . . . . 0.0 109.495 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.504 ' O ' ' O ' ' A' ' 5' ' ' ARG . 96.0 mt-10 -79.74 -170.84 2.57 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.23 -0.919 . . . . 0.0 109.451 179.625 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.504 ' O ' ' O ' ' A' ' 4' ' ' GLU . 84.5 mtp180 55.17 110.9 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.207 -0.933 . . . . 0.0 109.422 -179.802 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 26.3 mmtp -109.49 101.0 9.99 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.234 -0.916 . . . . 0.0 109.495 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 41.1 ttm180 -98.35 118.69 35.56 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.225 -0.922 . . . . 0.0 109.392 -179.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.555 ' CD1' ' N ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -132.53 152.03 51.71 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.239 -0.913 . . . . 0.0 109.503 179.284 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 79.3 tt0 -90.91 141.78 28.46 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.301 -0.874 . . . . 0.0 109.473 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.539 ' SG ' ' O ' ' A' ' 69' ' ' GLY . 0.8 OUTLIER -108.25 159.49 30.48 Favored Pre-proline 0 N--CA 1.49 1.533 0 O-C-N 121.336 -0.853 . . . . 0.0 109.454 179.841 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -65.05 -20.62 63.72 Favored 'Trans proline' 0 C--N 1.304 -1.764 0 C-N-CA 122.855 2.37 . . . . 0.0 112.237 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -93.29 -4.92 50.88 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.165 -0.959 . . . . 0.0 109.473 179.723 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 8.7 mp -98.95 113.41 64.54 Favored Pre-proline 0 N--CA 1.491 1.601 0 O-C-N 121.184 -0.948 . . . . 0.0 109.46 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -50.75 155.51 5.5 Favored 'Trans proline' 0 C--N 1.306 -1.707 0 C-N-CA 122.756 2.304 . . . . 0.0 112.261 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -49.93 106.8 0.13 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.305 -0.872 . . . . 0.0 109.523 179.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 125.89 -25.23 5.59 Favored Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.621 -1.392 . . . . 0.0 109.621 179.171 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 47.6 m95 -92.86 139.7 30.27 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.302 -1.116 . . . . 0.0 109.467 178.385 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -151.73 166.19 32.07 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.211 -0.93 . . . . 0.0 109.501 -178.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.511 ' NH1' ' OH ' ' A' ' 37' ' ' TYR . 12.1 ptm180 -140.92 145.86 36.64 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.27 -0.894 . . . . 0.0 109.384 178.887 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -132.92 145.98 51.39 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.239 -0.913 . . . . 0.0 109.462 -179.117 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 79.7 tt0 -100.01 136.67 39.55 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.271 -0.893 . . . . 0.0 109.452 178.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.5 t -135.4 133.71 20.67 Favored Pre-proline 0 N--CA 1.49 1.566 0 O-C-N 121.158 -0.964 . . . . 0.0 109.584 -178.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . 0.423 ' O ' ' N ' ' A' ' 25' ' ' ARG . 50.3 Cg_exo -50.11 150.86 9.75 Favored 'Trans proline' 0 C--N 1.304 -1.779 0 C-N-CA 122.821 2.347 . . . . 0.0 112.099 178.296 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.426 ' HD3' ' N ' ' A' ' 31' ' ' GLY . 0.0 OUTLIER -57.38 90.13 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.201 -0.937 . . . . 0.0 109.44 -179.648 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.423 ' N ' ' O ' ' A' ' 23' ' ' PRO . 97.0 mtt180 -56.25 -75.18 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.286 -0.884 . . . . 0.0 109.405 178.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 30.9 t -162.37 58.57 0.23 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.277 -0.89 . . . . 0.0 109.464 179.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -92.37 172.79 35.05 Favored Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.509 -1.437 . . . . 0.0 109.509 179.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.416 ' CD1' ' N ' ' A' ' 28' ' ' LEU . 10.9 mp -66.15 -40.66 90.74 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.304 -1.115 . . . . 0.0 109.489 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.545 ' O ' ' O ' ' A' ' 30' ' ' ALA . 92.5 p -97.44 20.44 11.66 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.133 -0.979 . . . . 0.0 109.435 -179.614 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.545 ' O ' ' O ' ' A' ' 29' ' ' SER . . . -42.76 170.62 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.27 -0.894 . . . . 0.0 109.466 179.842 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.426 ' N ' ' HD3' ' A' ' 24' ' ' ARG . . . 124.45 -16.45 7.52 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.488 -1.445 . . . . 0.0 109.488 -179.464 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 56.8 m80 -133.11 -146.06 0.26 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.174 -1.192 . . . . 0.0 109.493 179.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -116.8 134.77 54.38 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.14 -0.975 . . . . 0.0 109.492 179.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.597 ' OD2' ' CE2' ' A' ' 36' ' ' PHE . 9.2 t70 -103.12 140.73 36.94 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.202 -0.936 . . . . 0.0 109.481 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.592 ' O ' ' CD ' ' A' ' 46' ' ' ARG . 97.6 t -119.67 132.12 70.3 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.251 -0.905 . . . . 0.0 109.481 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.597 ' CE2' ' OD2' ' A' ' 34' ' ' ASP . 94.5 m-85 -116.2 150.89 36.76 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.221 -0.925 . . . . 0.0 109.542 -179.674 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.596 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 23.2 m-85 -112.69 147.15 37.39 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.257 -0.902 . . . . 0.0 109.463 179.737 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -126.39 139.44 53.27 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.214 -0.929 . . . . 0.0 109.552 -179.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.67 ' HG ' ' N ' ' A' ' 40' ' ' PRO . 0.2 OUTLIER -102.23 174.57 2.78 Favored Pre-proline 0 N--CA 1.489 1.51 0 O-C-N 121.251 -0.906 . . . . 0.0 109.419 179.33 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.67 ' N ' ' HG ' ' A' ' 39' ' ' SER . 52.8 Cg_exo -52.79 -35.95 71.59 Favored 'Trans proline' 0 C--N 1.306 -1.699 0 C-N-CA 122.85 2.367 . . . . 0.0 112.225 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 4.2 m -82.48 -1.01 49.02 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.342 -0.848 . . . . 0.0 109.476 -179.639 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 87.15 11.93 68.82 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -70.04 116.14 10.06 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.259 -1.142 . . . . 0.0 109.494 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 20.0 pttp -94.92 132.59 39.58 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.13 -0.981 . . . . 0.0 109.5 178.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.443 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 8.5 p90 -141.68 151.8 43.32 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.324 -0.86 . . . . 0.0 109.49 -179.776 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.592 ' CD ' ' O ' ' A' ' 35' ' ' VAL . 24.1 tpt85 -125.26 63.39 1.17 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.175 -0.953 . . . . 0.0 109.494 179.29 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.0 t -150.84 125.66 9.74 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.24 -0.913 . . . . 0.0 109.42 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.729 ' N ' ' HD2' ' A' ' 49' ' ' PRO . 20.1 tttt -65.21 -53.47 40.04 Favored Pre-proline 0 N--CA 1.489 1.48 0 O-C-N 121.233 -0.917 . . . . 0.0 109.506 -179.598 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.729 ' HD2' ' N ' ' A' ' 48' ' ' LYS . 14.5 Cg_endo -56.56 -38.69 94.95 Favored 'Trans proline' 0 C--N 1.304 -1.765 0 C-N-CA 122.877 2.385 . . . . 0.0 112.148 179.19 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -65.5 -35.22 80.23 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.344 -0.848 . . . . 0.0 109.432 179.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.4 ' C ' ' CD2' ' A' ' 51' ' ' LEU . 4.4 tt -68.54 -42.54 78.28 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.277 -0.89 . . . . 0.0 109.491 179.647 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.591 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -62.55 -41.28 98.8 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.268 -0.895 . . . . 0.0 109.463 -179.813 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 71.7 ttp85 -59.5 -48.66 80.79 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.175 -0.953 . . . . 0.0 109.457 179.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 6.2 t80 -63.79 -49.08 74.33 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.268 -0.895 . . . . 0.0 109.524 179.431 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.437 ' O ' ' O ' ' A' ' 59' ' ' MET . 3.3 mm? -81.34 -0.72 42.42 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.161 -0.962 . . . . 0.0 109.451 179.672 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.591 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -62.07 -35.15 91.05 Favored Glycine 0 N--CA 1.489 2.218 0 N-CA-C 109.604 -1.399 . . . . 0.0 109.604 -179.584 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -88.64 -3.12 78.02 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.459 -1.456 . . . . 0.0 109.459 -179.32 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -112.34 -30.7 7.08 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.308 -1.113 . . . . 0.0 109.494 -179.574 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.437 ' O ' ' O ' ' A' ' 55' ' ' LEU . 31.2 ttp -174.58 167.25 3.86 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.286 -0.884 . . . . 0.0 109.471 -179.771 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 93.7 m-20 -92.52 113.36 25.61 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.196 -0.94 . . . . 0.0 109.518 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 11.1 mp -111.61 9.54 21.11 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.246 -0.909 . . . . 0.0 109.505 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.44 ' HG ' ' N ' ' A' ' 63' ' ' THR . 88.5 p -55.78 -34.8 65.59 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.286 -0.884 . . . . 0.0 109.541 -179.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' THR . . . . . 0.44 ' N ' ' HG ' ' A' ' 62' ' ' SER . 10.4 p -91.83 24.86 2.98 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.281 -0.887 . . . . 0.0 109.445 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -91.41 126.18 36.41 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.103 -0.998 . . . . 0.0 109.438 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.552 ' O ' ' N ' ' A' ' 69' ' ' GLY . 96.5 m-20 -75.84 111.77 11.54 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.211 -0.93 . . . . 0.0 109.513 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.596 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 66.1 t80 -74.29 -45.01 50.36 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.236 -0.915 . . . . 0.0 109.49 -179.385 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 24.6 mmm180 -63.88 -37.9 89.11 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.2 -0.938 . . . . 0.0 109.471 -178.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.402 ' OG1' ' CB ' ' A' ' 65' ' ' ASP . 5.6 p -98.9 -15.26 19.24 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.297 -0.877 . . . . 0.0 109.538 -179.376 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.552 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 62.3 39.11 97.3 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.634 -1.386 . . . . 0.0 109.634 -179.842 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -133.42 151.59 51.82 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.216 -1.167 . . . . 0.0 109.413 -179.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 6.6 ttm -96.01 124.44 40.02 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.201 -0.937 . . . . 0.0 109.381 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 58.0 tp . . . . . 0 N--CA 1.491 1.614 0 O-C-N 121.274 -0.891 . . . . 0.0 109.428 -179.709 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.452 ' O ' ' C ' ' A' ' 2' ' ' SER . . . . . . . . 1 N--CA 1.531 4.984 0 N-CA-C 119.381 2.512 . . . . 0.0 119.381 . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.452 ' C ' ' O ' ' A' ' 1' ' ' GLY . 1.0 OUTLIER 41.27 35.04 0.37 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.245 -1.15 . . . . 0.0 109.413 179.991 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 67.0 mtt -82.39 142.31 32.07 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.282 -0.886 . . . . 0.0 109.41 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 82.9 tt0 -95.98 127.52 42.07 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.231 -0.918 . . . . 0.0 109.525 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 89.7 mtm180 -75.35 143.41 42.87 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.326 -0.859 . . . . 0.0 109.477 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.425 ' CE ' ' OE1' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -72.06 154.86 40.87 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.326 -0.859 . . . . 0.0 109.49 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 62.7 ttp180 -153.3 144.62 23.14 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.229 -0.92 . . . . 0.0 109.388 -179.495 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.627 ' CD1' ' N ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -166.1 139.48 4.18 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.15 -0.969 . . . . 0.0 109.536 -179.331 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -105.8 117.68 34.65 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.179 -0.951 . . . . 0.0 109.472 178.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.638 ' N ' HH12 ' A' ' 19' ' ' ARG . 10.1 p -92.37 137.45 24.64 Favored Pre-proline 0 N--CA 1.491 1.608 0 O-C-N 121.319 -0.863 . . . . 0.0 109.416 -178.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -69.89 -16.69 37.09 Favored 'Trans proline' 0 C--N 1.304 -1.794 0 C-N-CA 122.783 2.322 . . . . 0.0 112.262 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.22 -31.76 70.47 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.297 -0.877 . . . . 0.0 109.484 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.57 ' CD2' ' N ' ' A' ' 13' ' ' LEU . 3.7 mm? -95.39 154.44 39.37 Favored Pre-proline 0 N--CA 1.491 1.604 0 O-C-N 121.346 -0.846 . . . . 0.0 109.477 179.825 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -55.42 144.13 74.19 Favored 'Trans proline' 0 C--N 1.306 -1.704 0 C-N-CA 122.798 2.332 . . . . 0.0 112.165 179.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -49.18 129.15 17.72 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.268 -0.895 . . . . 0.0 109.485 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 118.04 -19.89 10.86 Favored Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.594 -1.403 . . . . 0.0 109.594 -179.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 20.7 m95 -85.09 144.09 28.45 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.232 -1.158 . . . . 0.0 109.45 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -144.63 157.06 44.37 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.253 -0.904 . . . . 0.0 109.477 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.638 HH12 ' N ' ' A' ' 10' ' ' CYS . 32.8 ptt-85 -147.25 152.54 38.48 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.179 -0.951 . . . . 0.0 109.381 179.502 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.401 ' O ' ' CD ' ' A' ' 20' ' ' GLU . 0.0 OUTLIER -150.61 151.0 31.89 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.28 -0.888 . . . . 0.0 109.526 -179.499 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.425 ' OE1' ' CE ' ' A' ' 6' ' ' LYS . 86.4 tt0 -96.57 146.06 25.16 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.268 -0.895 . . . . 0.0 109.326 179.184 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.8 t -144.43 122.79 6.82 Favored Pre-proline 0 N--CA 1.49 1.554 0 O-C-N 121.245 -0.909 . . . . 0.0 109.523 -178.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -75.76 136.51 18.99 Favored 'Trans proline' 0 C--N 1.306 -1.693 0 C-N-CA 122.828 2.352 . . . . 0.0 112.214 179.451 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 95.1 mtt-85 -64.64 148.46 50.89 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.18 -0.95 . . . . 0.0 109.534 -179.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 91.1 mtm-85 -132.18 -28.42 1.72 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.271 -0.893 . . . . 0.0 109.524 -179.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 46.8 t -138.11 97.16 3.33 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.195 -0.941 . . . . 0.0 109.493 179.705 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 176.18 165.57 32.14 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.595 -1.402 . . . . 0.0 109.595 -179.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.604 ' CD2' ' H ' ' A' ' 28' ' ' LEU . 0.1 OUTLIER -68.04 -45.06 75.0 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.288 -1.125 . . . . 0.0 109.447 -179.805 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.557 ' O ' ' C ' ' A' ' 30' ' ' ALA . 4.6 m -71.56 3.88 3.56 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.273 -0.892 . . . . 0.0 109.408 -179.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.557 ' C ' ' O ' ' A' ' 29' ' ' SER . . . -34.22 152.64 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.257 -0.902 . . . . 0.0 109.54 179.373 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 102.54 -36.6 4.18 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 37.7 m80 -87.15 168.35 13.33 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.23 -1.159 . . . . 0.0 109.461 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.39 139.49 52.73 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.234 -0.916 . . . . 0.0 109.385 -179.837 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.564 ' OD1' ' N ' ' A' ' 35' ' ' VAL . 67.3 t0 -119.37 142.01 48.54 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.269 -0.894 . . . . 0.0 109.455 -179.711 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.564 ' N ' ' OD1' ' A' ' 34' ' ' ASP . 62.7 t -110.58 140.82 27.99 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.246 -0.909 . . . . 0.0 109.397 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 65.0 m-85 -122.52 149.98 43.19 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.245 -0.91 . . . . 0.0 109.498 -179.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.562 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 22.3 m-85 -116.58 145.22 43.53 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.289 -0.882 . . . . 0.0 109.408 -179.884 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -120.5 134.87 55.22 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.209 -0.932 . . . . 0.0 109.445 -179.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.503 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -97.6 -179.56 0.9 Allowed Pre-proline 0 N--CA 1.491 1.586 0 O-C-N 121.301 -0.875 . . . . 0.0 109.358 179.221 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.503 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 39.2 Cg_exo -56.86 -28.97 79.69 Favored 'Trans proline' 0 C--N 1.306 -1.671 0 C-N-CA 122.836 2.357 . . . . 0.0 112.151 -179.633 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 94.1 p -91.44 2.48 56.38 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.261 -0.899 . . . . 0.0 109.518 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 83.45 14.78 72.95 Favored Glycine 0 N--CA 1.49 2.243 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -70.91 123.98 23.28 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.293 -1.122 . . . . 0.0 109.404 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.66 ' NZ ' HH22 ' A' ' 46' ' ' ARG . 18.6 pttp -95.32 129.6 42.4 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.216 -0.927 . . . . 0.0 109.48 179.202 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.659 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 0.7 OUTLIER -140.52 147.85 40.16 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.316 -0.865 . . . . 0.0 109.431 -179.837 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.66 HH22 ' NZ ' ' A' ' 44' ' ' LYS . 6.2 ptp85 -134.06 57.43 1.81 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.288 -0.882 . . . . 0.0 109.466 179.664 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -150.73 132.48 14.97 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.217 -0.927 . . . . 0.0 109.524 -179.78 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.722 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 2.7 tmtm? -71.25 -39.37 7.9 Favored Pre-proline 0 N--CA 1.491 1.593 0 O-C-N 121.319 -0.863 . . . . 0.0 109.488 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.722 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 33.0 Cg_exo -57.6 -55.17 2.61 Favored 'Trans proline' 0 C--N 1.306 -1.699 0 C-N-CA 122.894 2.396 . . . . 0.0 112.181 -179.556 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 26.7 tt0 -69.34 -31.83 70.53 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.274 -0.891 . . . . 0.0 109.474 179.437 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.503 ' C ' ' CD2' ' A' ' 51' ' ' LEU . 6.6 tt -67.78 -51.79 44.78 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.271 -0.893 . . . . 0.0 109.525 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.678 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -65.11 -42.74 93.7 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.163 -0.96 . . . . 0.0 109.511 179.885 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 80.3 mmt-85 -62.48 -37.89 87.71 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.269 -0.894 . . . . 0.0 109.521 -179.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 33.2 t80 -59.75 -51.66 68.8 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.313 -0.867 . . . . 0.0 109.445 -179.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.471 ' C ' ' H ' ' A' ' 57' ' ' GLY . 79.0 mt -100.3 5.63 44.54 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.24 -0.913 . . . . 0.0 109.517 179.683 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.678 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -52.72 -10.94 1.11 Allowed Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 -179.202 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . 0.471 ' H ' ' C ' ' A' ' 55' ' ' LEU . . . -106.22 -50.12 0.89 Allowed Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.556 -1.417 . . . . 0.0 109.556 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 95.1 p -63.64 -24.25 67.71 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.288 -1.125 . . . . 0.0 109.531 -179.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 2.1 mmm -169.77 163.42 9.83 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.23 -0.919 . . . . 0.0 109.405 -179.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 49.7 t0 -95.37 114.89 26.71 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.222 -0.924 . . . . 0.0 109.465 179.636 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 95.2 mt -110.61 7.05 22.25 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.227 -0.921 . . . . 0.0 109.467 -179.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 33.4 t -51.93 -32.05 31.38 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.2 -0.938 . . . . 0.0 109.437 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 24.2 p -91.99 14.31 16.15 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.238 -0.914 . . . . 0.0 109.452 -179.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.536 ' O ' ' NZ ' ' A' ' 48' ' ' LYS . 84.0 t80 -89.7 123.56 33.83 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.248 -0.908 . . . . 0.0 109.44 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 82.4 m-20 -78.59 124.19 27.9 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.325 -0.86 . . . . 0.0 109.448 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.562 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 77.5 t80 -77.45 -43.18 33.28 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.293 -0.879 . . . . 0.0 109.486 179.445 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.22 -45.39 94.77 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.286 -0.884 . . . . 0.0 109.459 -178.923 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 76.0 p -92.49 -17.85 23.96 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.274 -0.891 . . . . 0.0 109.5 -179.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 62.85 28.59 72.07 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.504 -1.438 . . . . 0.0 109.504 -179.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 64.4 mttp -125.25 153.49 43.11 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.324 -1.103 . . . . 0.0 109.44 -179.436 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 24.7 ttm -90.65 126.43 35.97 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.272 -0.893 . . . . 0.0 109.514 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 1.6 tt . . . . . 0 N--CA 1.489 1.517 0 O-C-N 121.171 -0.956 . . . . 0.0 109.527 179.75 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.645 ' C ' ' H ' ' A' ' 3' ' ' MET . . . . . . . . 1 N--CA 1.529 4.866 0 N-CA-C 119.353 2.501 . . . . 0.0 119.353 . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.1 t 67.16 -29.06 0.14 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.242 -1.152 . . . . 0.0 109.531 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.645 ' H ' ' C ' ' A' ' 1' ' ' GLY . 99.3 mmm -81.34 117.55 21.9 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.208 -0.932 . . . . 0.0 109.362 -179.9 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.602 ' N ' ' OE1' ' A' ' 4' ' ' GLU . 55.8 mp0 -94.11 17.84 11.81 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.293 -0.879 . . . . 0.0 109.47 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.449 ' NE ' ' OE2' ' A' ' 20' ' ' GLU . 79.3 mtp180 -88.41 111.85 22.24 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.278 -0.889 . . . . 0.0 109.421 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.44 ' HB3' ' CH2' ' A' ' 8' ' ' TRP . 59.8 mttt -82.9 168.83 16.69 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.183 -0.948 . . . . 0.0 109.472 -179.303 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.432 ' HG2' ' O ' ' A' ' 6' ' ' LYS . 22.7 mmt180 -146.57 138.01 24.45 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.154 -0.967 . . . . 0.0 109.455 -178.179 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.481 ' HE1' ' HB2' ' A' ' 21' ' ' GLU . 12.4 m95 -123.61 118.16 26.68 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.228 -0.92 . . . . 0.0 109.489 179.088 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 -78.41 148.83 33.47 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.22 -0.925 . . . . 0.0 109.518 178.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.536 ' SG ' ' NE ' ' A' ' 19' ' ' ARG . 20.8 p -135.13 101.5 11.29 Favored Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.155 -0.966 . . . . 0.0 109.494 -179.278 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -73.54 -11.44 24.36 Favored 'Trans proline' 0 C--N 1.305 -1.761 0 C-N-CA 122.836 2.358 . . . . 0.0 112.224 179.227 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -80.21 -21.14 43.23 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.221 -0.924 . . . . 0.0 109.409 178.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.565 ' CD2' ' N ' ' A' ' 13' ' ' LEU . 3.3 mm? -98.94 156.78 35.13 Favored Pre-proline 0 N--CA 1.489 1.499 0 O-C-N 121.198 -0.939 . . . . 0.0 109.43 179.544 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -52.79 147.51 31.68 Favored 'Trans proline' 0 C--N 1.305 -1.736 0 C-N-CA 122.838 2.359 . . . . 0.0 112.263 178.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 27.3 mm100 -56.64 125.47 22.39 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.232 -0.917 . . . . 0.0 109.507 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 124.54 -18.9 7.18 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.57 -1.412 . . . . 0.0 109.57 179.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 47.9 m95 -91.21 137.35 32.43 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.237 -1.154 . . . . 0.0 109.441 179.319 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -146.58 162.35 38.57 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.236 -0.915 . . . . 0.0 109.485 -179.151 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.536 ' NE ' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -123.04 160.24 26.73 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.274 -0.892 . . . . 0.0 109.473 178.812 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.449 ' OE2' ' NE ' ' A' ' 5' ' ' ARG . 75.6 tt0 -145.11 134.82 23.45 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.29 -0.881 . . . . 0.0 109.464 -179.082 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.481 ' HB2' ' HE1' ' A' ' 8' ' ' TRP . 4.0 tp10 -103.95 129.97 51.54 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.21 -0.931 . . . . 0.0 109.35 178.191 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.0 t -134.12 99.21 13.68 Favored Pre-proline 0 N--CA 1.489 1.476 0 O-C-N 121.271 -0.893 . . . . 0.0 109.593 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -58.03 135.19 67.08 Favored 'Trans proline' 0 C--N 1.304 -1.796 0 C-N-CA 122.858 2.372 . . . . 0.0 112.122 178.105 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.43 HH11 ' HD2' ' A' ' 24' ' ' ARG . 20.8 ttm105 -66.72 147.95 52.57 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.231 -0.918 . . . . 0.0 109.464 179.619 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -144.53 -31.44 0.44 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.239 -0.913 . . . . 0.0 109.46 -179.101 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 66.7 m -121.58 -3.05 9.33 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.259 -0.901 . . . . 0.0 109.403 -179.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -74.7 154.6 47.27 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 -179.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.472 ' C ' ' H ' ' A' ' 30' ' ' ALA . 56.9 tp -61.73 -40.25 94.43 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.303 -1.116 . . . . 0.0 109.457 179.763 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.553 ' O ' ' C ' ' A' ' 30' ' ' ALA . 4.0 t -77.27 26.33 0.16 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.229 -0.92 . . . . 0.0 109.436 -179.445 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.553 ' C ' ' O ' ' A' ' 29' ' ' SER . . . -33.01 150.71 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.277 -0.889 . . . . 0.0 109.443 179.542 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 104.84 -40.5 2.45 Favored Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 -179.461 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 71.0 m80 -90.62 158.57 16.88 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.241 -1.152 . . . . 0.0 109.447 179.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 37.2 ptt-85 -117.26 138.86 51.45 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.343 -0.848 . . . . 0.0 109.481 179.759 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -100.68 138.45 37.72 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.243 -0.911 . . . . 0.0 109.452 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 37.6 t -110.04 134.62 51.6 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.304 -0.872 . . . . 0.0 109.437 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -119.55 145.06 46.7 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.289 -0.882 . . . . 0.0 109.478 179.586 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.689 ' CE1' ' CZ ' ' A' ' 66' ' ' PHE . 7.7 m-85 -114.84 145.27 42.34 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.267 -0.895 . . . . 0.0 109.4 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -123.68 135.52 53.94 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.34 -0.85 . . . . 0.0 109.608 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.457 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -98.21 177.96 1.46 Allowed Pre-proline 0 N--CA 1.49 1.533 0 O-C-N 121.28 -0.888 . . . . 0.0 109.467 179.325 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.457 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 50.0 Cg_exo -55.08 -32.95 81.83 Favored 'Trans proline' 0 C--N 1.305 -1.731 0 C-N-CA 122.82 2.347 . . . . 0.0 112.339 179.862 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 41.1 t -87.52 4.35 43.87 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.341 -0.849 . . . . 0.0 109.494 -179.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 82.09 16.15 72.86 Favored Glycine 0 N--CA 1.489 2.175 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 -179.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -70.25 119.62 14.71 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.29 -1.123 . . . . 0.0 109.509 179.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.428 ' O ' ' CG ' ' A' ' 44' ' ' LYS . 24.3 pttm -94.8 125.03 39.19 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.235 -0.916 . . . . 0.0 109.494 178.873 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 31.8 p90 -141.48 149.04 40.4 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.214 -0.929 . . . . 0.0 109.557 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 26.5 ptt-85 -133.91 60.78 1.69 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.178 -0.951 . . . . 0.0 109.439 179.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.2 m -155.62 138.83 15.63 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.243 -0.911 . . . . 0.0 109.469 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.606 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 2.3 tttm -65.9 -45.8 64.65 Favored Pre-proline 0 N--CA 1.49 1.536 0 O-C-N 121.245 -0.909 . . . . 0.0 109.41 -179.719 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.606 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 49.0 Cg_exo -54.97 -44.4 50.13 Favored 'Trans proline' 0 C--N 1.306 -1.679 0 C-N-CA 122.84 2.36 . . . . 0.0 112.228 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -67.78 -38.15 83.0 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.236 -0.915 . . . . 0.0 109.444 179.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 55.3 tp -65.87 -45.8 80.77 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.31 -0.869 . . . . 0.0 109.397 -179.329 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.707 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -69.02 -44.56 72.48 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.302 -0.874 . . . . 0.0 109.529 -179.648 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 7.9 tpt180 -60.22 -43.3 96.13 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.267 -0.896 . . . . 0.0 109.456 -179.474 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 25.9 t80 -62.64 -52.86 61.68 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.181 -0.95 . . . . 0.0 109.451 -179.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.403 ' O ' ' C ' ' A' ' 56' ' ' GLY . 97.6 mt -90.9 2.53 56.12 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.271 -0.893 . . . . 0.0 109.464 179.78 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.707 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -45.06 -78.13 0.08 OUTLIER Glycine 0 N--CA 1.491 2.359 0 N-CA-C 109.471 -1.452 . . . . 0.0 109.471 -179.913 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.32 7.47 0.22 Allowed Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 -179.564 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.601 ' H ' ' C ' ' A' ' 56' ' ' GLY . 3.0 m -104.19 -27.03 12.29 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.228 -1.16 . . . . 0.0 109.533 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 1.7 ptp 178.1 171.25 0.7 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.253 -0.905 . . . . 0.0 109.48 -179.463 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 59.6 t0 -93.56 111.44 23.11 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.194 -0.942 . . . . 0.0 109.397 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 10.7 mp -99.73 5.1 45.71 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.239 -0.913 . . . . 0.0 109.428 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 23.4 m -46.16 -38.78 8.68 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.279 -0.888 . . . . 0.0 109.462 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 55.8 p -95.35 49.65 1.21 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.301 -0.874 . . . . 0.0 109.4 179.315 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 65.9 t80 -116.61 132.16 56.76 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.302 -0.874 . . . . 0.0 109.477 -179.576 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 91.8 m-20 -93.42 107.75 19.53 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.188 -0.945 . . . . 0.0 109.544 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.689 ' CZ ' ' CE1' ' A' ' 37' ' ' TYR . 53.2 t80 -75.43 -40.36 57.78 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.339 -0.851 . . . . 0.0 109.465 -179.723 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 27.9 mmt180 -62.05 -32.89 73.45 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.282 -0.886 . . . . 0.0 109.464 -179.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 16.1 p -95.22 -15.23 23.4 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.258 -0.901 . . . . 0.0 109.486 -179.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 67.12 27.02 73.34 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.579 -1.408 . . . . 0.0 109.579 -179.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -138.19 158.0 45.17 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.198 -1.178 . . . . 0.0 109.47 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.427 ' O ' ' C ' ' A' ' 72' ' ' LEU . 19.9 ttm -91.35 132.76 35.97 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.192 -0.942 . . . . 0.0 109.543 -179.763 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.427 ' C ' ' O ' ' A' ' 71' ' ' MET . 56.1 tp . . . . . 0 N--CA 1.49 1.567 0 O-C-N 121.281 -0.887 . . . . 0.0 109.528 -179.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.528 4.832 0 N-CA-C 119.431 2.532 . . . . 0.0 119.431 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 41.6 t -107.6 153.07 23.42 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.318 -1.107 . . . . 0.0 109.479 -179.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 57.1 mtt 53.82 39.85 30.83 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.233 -0.917 . . . . 0.0 109.41 179.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 76.9 mm-40 -98.48 115.14 27.91 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.325 -0.859 . . . . 0.0 109.464 179.517 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 84.0 mtt85 -127.22 132.14 50.49 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.175 -0.953 . . . . 0.0 109.512 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 26.1 mmtp -100.32 98.04 8.74 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.159 -0.963 . . . . 0.0 109.532 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.586 HH21 ' CD ' ' A' ' 18' ' ' GLU . 85.2 mtp180 -70.66 166.2 21.28 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.173 -0.954 . . . . 0.0 109.465 -179.405 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.491 ' CG ' ' O ' ' A' ' 7' ' ' ARG . 1.3 m0 -165.8 141.9 5.15 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.235 -0.916 . . . . 0.0 109.542 -179.474 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -111.29 139.59 46.56 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.247 -0.908 . . . . 0.0 109.493 179.256 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.7 t -127.58 140.6 38.49 Favored Pre-proline 0 N--CA 1.49 1.567 0 O-C-N 121.247 -0.908 . . . . 0.0 109.505 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -51.11 -31.79 37.05 Favored 'Trans proline' 0 C--N 1.305 -1.756 0 C-N-CA 122.812 2.342 . . . . 0.0 112.157 179.333 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -76.89 -10.73 59.57 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.164 -0.96 . . . . 0.0 109.462 -179.492 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.6 mp -90.43 116.17 65.79 Favored Pre-proline 0 N--CA 1.49 1.567 0 O-C-N 121.243 -0.911 . . . . 0.0 109.495 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.415 ' O ' ' C ' ' A' ' 15' ' ' GLN . 48.6 Cg_exo -51.04 141.93 35.98 Favored 'Trans proline' 0 C--N 1.305 -1.725 0 C-N-CA 122.832 2.355 . . . . 0.0 112.244 -179.551 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.415 ' C ' ' O ' ' A' ' 14' ' ' PRO . 0.0 OUTLIER -44.64 107.17 0.09 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.249 -0.907 . . . . 0.0 109.523 -179.498 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 127.13 -23.87 5.45 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 178.725 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 24.1 m95 -80.04 139.13 37.07 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.215 -1.168 . . . . 0.0 109.46 178.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.586 ' CD ' HH21 ' A' ' 7' ' ' ARG . 97.0 mt-10 -127.95 150.47 49.88 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.248 -0.908 . . . . 0.0 109.432 -178.089 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.402 ' NH1' ' HA3' ' A' ' 69' ' ' GLY . 53.8 ttp180 -128.16 149.89 50.24 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.219 -0.926 . . . . 0.0 109.493 177.807 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 18.8 pt-20 -156.07 141.02 17.25 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.288 -0.883 . . . . 0.0 109.496 -179.226 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 79.6 tt0 -98.49 133.04 43.41 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.229 -0.919 . . . . 0.0 109.352 178.458 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.6 t -139.78 103.46 6.95 Favored Pre-proline 0 N--CA 1.49 1.559 0 O-C-N 121.182 -0.948 . . . . 0.0 109.533 -178.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . 0.448 ' HA ' ' HA ' ' A' ' 33' ' ' ARG . 47.1 Cg_exo -55.38 129.34 34.67 Favored 'Trans proline' 0 C--N 1.305 -1.715 0 C-N-CA 122.881 2.387 . . . . 0.0 112.203 178.685 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -59.26 141.18 54.99 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.203 -0.936 . . . . 0.0 109.476 179.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.572 ' O ' ' O ' ' A' ' 26' ' ' SER . 27.1 mmt180 -121.53 5.34 10.11 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.286 -0.884 . . . . 0.0 109.462 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.572 ' O ' ' O ' ' A' ' 25' ' ' ARG . 47.5 t -34.41 -94.54 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.347 -0.846 . . . . 0.0 109.467 -179.591 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -155.67 -92.53 0.09 OUTLIER Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.525 -1.43 . . . . 0.0 109.525 -179.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.4 tt -65.67 -44.1 87.29 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.287 -1.125 . . . . 0.0 109.436 -179.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.497 ' O ' ' C ' ' A' ' 30' ' ' ALA . 6.2 m -74.16 -20.64 60.16 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.286 -0.884 . . . . 0.0 109.578 -179.886 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.497 ' C ' ' O ' ' A' ' 29' ' ' SER . . . -39.07 132.58 1.3 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.281 -0.887 . . . . 0.0 109.394 179.518 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 123.88 -41.03 1.82 Allowed Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.531 -1.428 . . . . 0.0 109.531 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 52.8 m-70 -57.29 102.1 0.08 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.205 -1.174 . . . . 0.0 109.447 179.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.448 ' HA ' ' HA ' ' A' ' 23' ' ' PRO . 99.6 mtt180 -53.67 132.39 40.76 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.229 -0.919 . . . . 0.0 109.458 179.555 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.607 ' OD1' ' N ' ' A' ' 35' ' ' VAL . 66.8 t0 -125.64 149.37 48.48 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.34 -0.85 . . . . 0.0 109.433 179.493 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.607 ' N ' ' OD1' ' A' ' 34' ' ' ASP . 64.0 t -117.06 133.75 62.82 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 O-C-N 121.247 -0.908 . . . . 0.0 109.469 -179.113 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.406 ' CZ ' ' OD2' ' A' ' 34' ' ' ASP . 96.7 m-85 -122.56 146.05 47.77 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.287 -0.883 . . . . 0.0 109.468 179.19 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.437 ' HB2' ' CE2' ' A' ' 45' ' ' PHE . 41.5 m-85 -116.07 151.34 35.74 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.262 -0.899 . . . . 0.0 109.501 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 67.5 m-85 -126.07 136.77 53.32 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.324 -0.86 . . . . 0.0 109.508 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.654 ' HG ' ' N ' ' A' ' 40' ' ' PRO . 0.4 OUTLIER -98.05 178.98 1.17 Allowed Pre-proline 0 N--CA 1.49 1.547 0 O-C-N 121.285 -0.884 . . . . 0.0 109.433 179.695 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.654 ' N ' ' HG ' ' A' ' 39' ' ' SER . 43.0 Cg_exo -55.67 -30.21 74.35 Favored 'Trans proline' 0 C--N 1.304 -1.802 0 C-N-CA 122.779 2.32 . . . . 0.0 112.212 -179.831 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.49 ' H ' ' HG ' ' A' ' 39' ' ' SER . 99.8 p -87.37 4.07 44.52 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.225 -0.922 . . . . 0.0 109.488 -179.567 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 77.61 17.09 79.43 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.557 -1.417 . . . . 0.0 109.557 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.25 125.52 29.58 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.276 -1.132 . . . . 0.0 109.493 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 24.8 pttm -92.29 135.52 33.95 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.3 -0.875 . . . . 0.0 109.475 179.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.588 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 1.3 p90 -140.34 146.92 39.09 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.262 -0.899 . . . . 0.0 109.416 179.714 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 19.0 ttm180 -131.56 59.36 1.7 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.241 -0.912 . . . . 0.0 109.548 179.296 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -160.92 141.65 11.47 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.234 -0.916 . . . . 0.0 109.421 -179.725 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.735 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 16.9 tptm -69.92 -37.92 8.5 Favored Pre-proline 0 N--CA 1.49 1.574 0 O-C-N 121.291 -0.881 . . . . 0.0 109.474 -179.291 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.735 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 33.6 Cg_exo -61.21 -51.24 4.68 Favored 'Trans proline' 0 C--N 1.305 -1.728 0 C-N-CA 122.866 2.378 . . . . 0.0 112.224 179.554 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -64.77 -34.9 79.42 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.257 -0.902 . . . . 0.0 109.463 179.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 5.6 tt -62.44 -48.36 80.0 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.242 -0.911 . . . . 0.0 109.405 -179.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -69.91 -42.62 73.11 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.267 -0.896 . . . . 0.0 109.438 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 61.5 ttp180 -59.05 -41.37 87.76 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.389 -0.819 . . . . 0.0 109.539 179.453 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 50.4 t80 -60.0 -54.49 45.4 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.218 -0.926 . . . . 0.0 109.454 -179.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.488 ' O ' ' OG ' ' A' ' 58' ' ' SER . 36.3 mt -63.62 -42.07 98.22 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.199 -0.938 . . . . 0.0 109.473 179.821 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 72.73 -139.76 27.97 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -84.86 -0.1 89.11 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.488 ' OG ' ' O ' ' A' ' 55' ' ' LEU . 78.0 p -66.43 -32.84 74.47 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.216 -1.167 . . . . 0.0 109.429 -179.744 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 44.4 mmm -144.42 135.78 25.5 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.213 -0.929 . . . . 0.0 109.469 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.461 ' O ' ' OD1' ' A' ' 60' ' ' ASP . 39.7 p-10 -93.13 112.3 24.2 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.231 -0.918 . . . . 0.0 109.551 179.326 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 9.7 mp -117.67 14.14 14.36 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.153 -0.967 . . . . 0.0 109.507 -179.246 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 83.3 p -49.38 -34.82 17.09 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.201 -0.937 . . . . 0.0 109.49 179.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 40.3 p -100.33 36.06 1.96 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.234 -0.916 . . . . 0.0 109.435 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.515 ' O ' ' NZ ' ' A' ' 48' ' ' LYS . 80.2 t80 -105.71 129.14 53.99 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.274 -0.891 . . . . 0.0 109.497 -179.792 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.522 ' CG ' ' HG1' ' A' ' 68' ' ' THR . 55.1 t0 -86.68 118.77 26.3 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.3 -0.875 . . . . 0.0 109.456 179.956 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 65.3 t80 -81.44 -37.57 27.84 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.245 -0.909 . . . . 0.0 109.463 -179.519 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 24.4 mmt180 -63.95 -43.32 96.19 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.201 -0.937 . . . . 0.0 109.483 -179.054 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.522 ' HG1' ' CG ' ' A' ' 65' ' ' ASP . 71.1 p -95.61 -19.74 19.52 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.294 -0.879 . . . . 0.0 109.483 -179.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.402 ' HA3' ' NH1' ' A' ' 19' ' ' ARG . . . 67.57 53.14 26.0 Favored Glycine 0 N--CA 1.489 2.232 0 N-CA-C 109.549 -1.421 . . . . 0.0 109.549 178.943 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 19.8 ptmt -150.3 151.77 33.46 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.199 -1.177 . . . . 0.0 109.433 179.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 38.1 ttm -95.22 124.81 39.45 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.22 -0.925 . . . . 0.0 109.494 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 60.5 tp . . . . . 0 N--CA 1.49 1.553 0 O-C-N 121.262 -0.899 . . . . 0.0 109.472 -179.603 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.528 4.833 0 N-CA-C 119.361 2.504 . . . . 0.0 119.361 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 58.5 m -65.9 -72.46 0.16 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.268 -1.136 . . . . 0.0 109.464 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 77.7 mtm -92.4 120.16 32.63 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.237 -0.914 . . . . 0.0 109.429 179.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -105.71 167.45 9.76 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.308 -0.87 . . . . 0.0 109.484 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 66.7 ttp85 60.13 105.53 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.219 -0.926 . . . . 0.0 109.475 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 40.1 mttt -103.54 107.7 18.65 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.176 -0.952 . . . . 0.0 109.442 -179.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 3.4 ptp180 -70.07 167.01 18.57 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.241 -0.912 . . . . 0.0 109.487 -179.466 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.802 ' HE1' ' H ' ' A' ' 21' ' ' GLU . 60.9 m95 -143.33 129.42 19.69 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.246 -0.909 . . . . 0.0 109.499 179.827 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -58.06 139.12 55.28 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.25 -0.907 . . . . 0.0 109.546 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -71.16 126.92 91.98 Favored Pre-proline 0 N--CA 1.491 1.589 0 O-C-N 121.237 -0.915 . . . . 0.0 109.456 -179.717 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -74.06 -59.72 0.05 OUTLIER 'Trans proline' 0 C--N 1.303 -1.818 0 C-N-CA 122.823 2.348 . . . . 0.0 112.198 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.489 ' CB ' ' SD ' ' A' ' 71' ' ' MET . . . -116.28 -28.95 6.37 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.325 -0.859 . . . . 0.0 109.476 179.322 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.462 ' C ' ' O ' ' A' ' 12' ' ' ALA . 5.3 mp -40.7 157.49 0.18 Allowed Pre-proline 0 N--CA 1.491 1.608 0 O-C-N 121.177 -0.952 . . . . 0.0 109.462 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.494 ' HG2' ' CD1' ' A' ' 17' ' ' TRP . 34.0 Cg_endo -66.29 151.69 82.8 Favored 'Trans proline' 0 C--N 1.305 -1.746 0 C-N-CA 122.836 2.358 . . . . 0.0 112.205 179.042 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -58.58 123.45 16.31 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.268 -0.895 . . . . 0.0 109.498 -178.518 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 125.69 -27.14 5.26 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.489 -1.444 . . . . 0.0 109.489 178.419 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . 0.494 ' CD1' ' HG2' ' A' ' 14' ' ' PRO . 15.5 m95 -84.78 143.23 29.25 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.235 -1.156 . . . . 0.0 109.441 179.585 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 75.1 tt0 -136.13 151.85 50.2 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.261 -0.899 . . . . 0.0 109.544 -178.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.411 ' NH1' ' HA3' ' A' ' 69' ' ' GLY . 26.5 mtm105 -121.88 163.25 19.55 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.242 -0.911 . . . . 0.0 109.445 178.373 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -155.78 128.53 7.92 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.214 -0.929 . . . . 0.0 109.492 -179.513 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.802 ' H ' ' HE1' ' A' ' 8' ' ' TRP . 92.0 mt-10 -89.8 134.19 34.32 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.278 -0.889 . . . . 0.0 109.324 178.858 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.524 ' O ' ' OD1' ' A' ' 34' ' ' ASP . 25.5 t -137.25 100.43 9.49 Favored Pre-proline 0 N--CA 1.49 1.557 0 O-C-N 121.225 -0.922 . . . . 0.0 109.61 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_exo -54.6 131.35 45.18 Favored 'Trans proline' 0 C--N 1.304 -1.789 0 C-N-CA 122.822 2.348 . . . . 0.0 112.207 179.001 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.432 HH12 ' HB2' ' A' ' 29' ' ' SER . 84.4 mtp180 -74.49 159.39 32.32 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.206 -0.934 . . . . 0.0 109.53 179.602 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 65.5 ttt180 -167.27 19.18 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.277 -0.89 . . . . 0.0 109.54 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -149.37 -43.4 0.14 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.369 -0.832 . . . . 0.0 109.543 -179.688 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -50.93 155.93 2.99 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 57.3 tp -62.32 -41.36 98.49 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.319 -1.106 . . . . 0.0 109.481 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.539 ' O ' ' O ' ' A' ' 30' ' ' ALA . 73.4 m -83.03 13.2 4.18 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.261 -0.9 . . . . 0.0 109.451 -179.732 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.539 ' O ' ' O ' ' A' ' 29' ' ' SER . . . -42.39 169.68 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.273 -0.892 . . . . 0.0 109.475 179.709 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 113.73 -26.52 10.0 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.519 -1.433 . . . . 0.0 109.519 -179.481 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 30.3 m170 -107.88 -179.96 4.05 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.261 -1.141 . . . . 0.0 109.474 179.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -113.24 133.15 55.23 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.274 -0.891 . . . . 0.0 109.556 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.524 ' OD1' ' O ' ' A' ' 22' ' ' VAL . 7.5 p30 -104.25 136.65 43.46 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.352 -0.843 . . . . 0.0 109.484 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 38.9 t -110.79 134.78 51.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.358 -0.839 . . . . 0.0 109.477 179.317 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -114.36 149.49 36.02 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.294 -0.878 . . . . 0.0 109.516 -179.616 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.563 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 17.1 m-85 -118.83 149.82 40.88 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.197 -0.939 . . . . 0.0 109.467 179.515 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.436 ' CD1' ' N ' ' A' ' 38' ' ' TYR . 15.0 m-85 -129.86 140.3 51.02 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.184 -0.947 . . . . 0.0 109.616 -179.696 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.43 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -109.74 176.94 1.36 Allowed Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.266 -0.896 . . . . 0.0 109.403 179.665 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.43 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 52.2 Cg_exo -53.26 -33.27 64.53 Favored 'Trans proline' 0 C--N 1.305 -1.741 0 C-N-CA 122.872 2.382 . . . . 0.0 112.246 179.551 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 20.9 t -76.41 -5.28 46.65 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.255 -0.903 . . . . 0.0 109.475 179.603 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 80.28 15.04 79.4 Favored Glycine 0 N--CA 1.489 2.206 0 N-CA-C 109.496 -1.442 . . . . 0.0 109.496 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -78.24 124.86 28.56 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.273 -1.134 . . . . 0.0 109.461 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.8 ptmm? -95.16 121.6 36.97 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.256 -0.903 . . . . 0.0 109.586 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -142.71 155.04 44.83 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.268 -0.895 . . . . 0.0 109.477 178.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.72 ' O ' ' C ' ' A' ' 47' ' ' SER . 5.0 ptt180 -130.77 -66.71 0.75 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.271 -0.893 . . . . 0.0 109.491 179.16 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.72 ' C ' ' O ' ' A' ' 46' ' ' ARG . 1.7 m -15.82 125.91 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.337 -0.852 . . . . 0.0 109.559 179.226 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.621 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 5.1 tmtp? -59.58 -45.56 98.7 Favored Pre-proline 0 N--CA 1.491 1.617 0 O-C-N 121.296 -0.877 . . . . 0.0 109.408 -179.646 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.621 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 52.5 Cg_exo -53.85 -46.08 36.28 Favored 'Trans proline' 0 C--N 1.305 -1.755 0 C-N-CA 122.837 2.358 . . . . 0.0 112.208 -179.42 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -66.41 -35.74 81.08 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.281 -0.887 . . . . 0.0 109.536 179.347 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 62.3 tp -63.04 -45.32 92.85 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.279 -0.888 . . . . 0.0 109.477 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.627 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -67.27 -40.58 86.18 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.174 -0.954 . . . . 0.0 109.472 -179.5 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 82.6 mtp180 -60.88 -42.14 97.37 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.331 -0.855 . . . . 0.0 109.517 -179.424 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 24.5 t80 -60.99 -53.83 52.45 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.189 -0.944 . . . . 0.0 109.464 -179.713 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.521 ' O ' ' N ' ' A' ' 57' ' ' GLY . 93.2 mt -88.13 1.89 53.3 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.29 -0.881 . . . . 0.0 109.504 179.356 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.627 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -44.67 94.69 0.01 OUTLIER Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.46 -1.456 . . . . 0.0 109.46 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . 0.521 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . 125.05 -52.33 0.8 Allowed Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.465 -1.454 . . . . 0.0 109.465 179.837 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.1 m -63.0 -34.6 77.89 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.213 -1.169 . . . . 0.0 109.454 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 51.6 ttp -163.98 157.81 18.92 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.251 -0.906 . . . . 0.0 109.465 -179.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 51.4 t0 -89.38 110.26 21.09 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.252 -0.905 . . . . 0.0 109.512 -179.688 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.518 ' CD2' ' N ' ' A' ' 61' ' ' LEU . 4.0 mm? -93.78 -3.76 51.51 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.267 -0.896 . . . . 0.0 109.469 -179.733 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 38.4 t -59.45 -39.49 83.77 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.216 -0.927 . . . . 0.0 109.395 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 65.9 p -86.71 14.55 6.87 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.182 -0.949 . . . . 0.0 109.424 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -91.55 129.64 37.5 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.177 -0.952 . . . . 0.0 109.462 -179.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.52 ' O ' ' N ' ' A' ' 69' ' ' GLY . 60.9 t0 -80.03 112.19 17.1 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.196 -0.94 . . . . 0.0 109.472 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.563 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 48.2 t80 -75.13 -44.15 48.59 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.233 -0.917 . . . . 0.0 109.468 -179.006 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.403 ' HD2' ' N ' ' A' ' 67' ' ' ARG . 10.9 mpt_? -60.34 -42.52 95.88 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.198 -0.939 . . . . 0.0 109.518 -178.794 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.482 ' OG1' ' CG ' ' A' ' 65' ' ' ASP . 30.0 p -97.83 -13.85 21.08 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.302 -0.874 . . . . 0.0 109.497 -179.459 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.52 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 63.25 39.47 97.92 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.481 -1.448 . . . . 0.0 109.481 -179.841 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 51.4 mttp -137.35 156.55 48.09 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.223 -1.163 . . . . 0.0 109.461 -179.487 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.489 ' SD ' ' CB ' ' A' ' 12' ' ' ALA . 37.2 mtt -84.95 148.47 26.2 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.199 -0.938 . . . . 0.0 109.442 -180.0 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 56.0 tp . . . . . 0 N--CA 1.49 1.546 0 O-C-N 121.282 -0.886 . . . . 0.0 109.446 179.967 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.499 ' O ' ' O ' ' A' ' 2' ' ' SER . . . . . . . . 1 N--CA 1.529 4.834 0 N-CA-C 119.378 2.511 . . . . 0.0 119.378 . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.499 ' O ' ' O ' ' A' ' 1' ' ' GLY . 1.4 t 51.33 103.31 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.255 -1.144 . . . . 0.0 109.537 -179.602 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -79.42 116.55 19.72 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.331 -0.856 . . . . 0.0 109.416 -179.873 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -142.99 -157.52 0.78 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.304 -0.872 . . . . 0.0 109.472 179.593 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 35.3 ptt180 -76.95 142.39 40.05 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.331 -0.855 . . . . 0.0 109.47 179.815 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.446 ' N ' ' HD3' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -114.39 113.09 24.05 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.244 -0.91 . . . . 0.0 109.442 179.883 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.52 ' NH2' ' OE1' ' A' ' 18' ' ' GLU . 69.4 mtp85 -72.01 168.06 18.84 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.273 -0.892 . . . . 0.0 109.38 -179.932 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.59 ' N ' ' O ' ' A' ' 19' ' ' ARG . 53.0 m95 -136.28 124.7 23.42 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.197 -0.939 . . . . 0.0 109.427 -179.418 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.521 ' N ' ' OE1' ' A' ' 9' ' ' GLU . 58.5 mp0 -90.78 117.07 29.12 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.279 -0.888 . . . . 0.0 109.398 179.769 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 46.4 t -119.24 100.32 50.15 Favored Pre-proline 0 N--CA 1.491 1.608 0 O-C-N 121.34 -0.85 . . . . 0.0 109.522 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_exo -55.2 -25.44 46.38 Favored 'Trans proline' 0 C--N 1.305 -1.749 0 C-N-CA 122.945 2.43 . . . . 0.0 112.19 178.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.45 -35.08 69.65 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.267 -0.895 . . . . 0.0 109.47 -179.81 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.613 ' CD2' ' N ' ' A' ' 13' ' ' LEU . 3.2 mm? -89.97 154.9 47.64 Favored Pre-proline 0 N--CA 1.49 1.555 0 O-C-N 121.201 -0.937 . . . . 0.0 109.402 179.793 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_exo -52.1 146.7 29.4 Favored 'Trans proline' 0 C--N 1.306 -1.709 0 C-N-CA 122.78 2.32 . . . . 0.0 112.231 179.064 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 8.7 mp0 -55.29 124.08 15.89 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.252 -0.905 . . . . 0.0 109.509 -179.757 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 124.31 -22.47 6.64 Favored Glycine 0 N--CA 1.49 2.243 0 N-CA-C 109.647 -1.381 . . . . 0.0 109.647 179.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 52.4 m95 -85.36 136.16 33.59 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.177 -1.19 . . . . 0.0 109.473 179.205 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.52 ' OE1' ' NH2' ' A' ' 7' ' ' ARG . 72.4 mt-10 -142.41 155.7 45.14 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.326 -0.859 . . . . 0.0 109.424 -179.126 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.602 HH22 ' CD2' ' A' ' 13' ' ' LEU . 0.0 OUTLIER -138.56 140.24 38.97 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.211 -0.93 . . . . 0.0 109.399 178.953 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -132.89 142.59 49.0 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.241 -0.912 . . . . 0.0 109.481 -178.365 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.495 ' HG3' ' HE1' ' A' ' 8' ' ' TRP . 92.4 mt-10 -98.99 142.58 30.3 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.376 -0.827 . . . . 0.0 109.392 178.391 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 10.4 t -145.17 123.39 6.53 Favored Pre-proline 0 N--CA 1.491 1.598 0 O-C-N 121.219 -0.925 . . . . 0.0 109.611 -179.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -74.84 135.55 19.56 Favored 'Trans proline' 0 C--N 1.304 -1.813 0 C-N-CA 122.879 2.386 . . . . 0.0 112.214 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.415 HH21 ' HA3' ' A' ' 27' ' ' GLY . 78.3 mtp85 -78.24 166.21 22.99 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.273 -0.892 . . . . 0.0 109.484 179.652 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 57.5 ttp180 -170.33 -9.2 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.213 -0.93 . . . . 0.0 109.523 -179.425 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 15.9 t -126.84 -20.8 4.17 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.251 -0.906 . . . . 0.0 109.417 -179.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.415 ' HA3' HH21 ' A' ' 24' ' ' ARG . . . -73.36 165.83 54.73 Favored Glycine 0 N--CA 1.492 2.387 0 N-CA-C 109.549 -1.42 . . . . 0.0 109.549 -179.831 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 58.3 tp -62.54 -40.94 98.38 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.255 -1.144 . . . . 0.0 109.461 179.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.541 ' O ' ' C ' ' A' ' 30' ' ' ALA . 83.7 p -79.8 15.34 1.42 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.292 -0.88 . . . . 0.0 109.442 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.541 ' C ' ' O ' ' A' ' 29' ' ' SER . . . -35.89 152.82 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.21 -0.931 . . . . 0.0 109.475 179.804 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 102.9 -37.68 3.59 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.554 -1.418 . . . . 0.0 109.554 -179.625 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 33.2 m170 -85.39 168.44 14.62 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.356 -1.084 . . . . 0.0 109.455 179.555 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -114.98 128.04 56.04 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.245 -0.909 . . . . 0.0 109.518 -179.52 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 22.7 m-20 -106.92 137.42 45.01 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.211 -0.931 . . . . 0.0 109.419 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 3.0 t -106.91 135.03 46.83 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.246 -0.909 . . . . 0.0 109.411 179.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -113.7 141.54 47.11 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.313 -0.867 . . . . 0.0 109.524 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.709 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 17.5 m-85 -114.36 142.05 46.83 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.281 -0.887 . . . . 0.0 109.357 -179.352 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 86.2 m-85 -123.06 135.09 54.27 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.307 -0.871 . . . . 0.0 109.47 -179.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.454 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -97.2 177.56 1.63 Allowed Pre-proline 0 N--CA 1.491 1.592 0 O-C-N 121.191 -0.943 . . . . 0.0 109.426 179.593 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.454 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 47.4 Cg_exo -54.49 -31.37 68.78 Favored 'Trans proline' 0 C--N 1.304 -1.809 0 C-N-CA 122.848 2.365 . . . . 0.0 112.258 -179.656 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 71.8 m -88.62 7.08 35.21 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.316 -0.865 . . . . 0.0 109.476 179.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 79.95 10.7 85.33 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 -179.584 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -64.22 122.75 17.37 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.168 -1.195 . . . . 0.0 109.457 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 13.5 ptpt -95.88 126.88 41.44 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.242 -0.911 . . . . 0.0 109.525 178.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.634 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 1.1 p90 -139.92 146.46 39.24 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.296 -0.877 . . . . 0.0 109.47 -179.919 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 28.4 ptt-85 -134.79 53.59 1.98 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.3 -0.875 . . . . 0.0 109.549 179.213 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.4 p -159.41 144.71 15.77 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.285 -0.884 . . . . 0.0 109.563 -179.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.666 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 0.6 OUTLIER -69.39 -42.29 20.06 Favored Pre-proline 0 N--CA 1.49 1.545 0 O-C-N 121.211 -0.931 . . . . 0.0 109.4 -179.473 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.666 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 42.9 Cg_exo -57.54 -48.98 14.83 Favored 'Trans proline' 0 C--N 1.305 -1.752 0 C-N-CA 122.898 2.399 . . . . 0.0 112.231 -179.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.402 HE21 ' CB ' ' A' ' 45' ' ' PHE . 18.3 tt0 -65.84 -38.07 87.89 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.275 -0.891 . . . . 0.0 109.388 179.54 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 37.0 tp -64.02 -45.41 89.02 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.274 -0.891 . . . . 0.0 109.493 -179.636 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.591 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -65.86 -43.98 86.77 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.262 -0.899 . . . . 0.0 109.425 -179.665 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 15.1 tpp180 -56.06 -42.88 77.33 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.251 -0.905 . . . . 0.0 109.448 -179.419 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 56.2 t80 -61.1 -52.14 66.17 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.207 -0.933 . . . . 0.0 109.387 -179.215 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.416 ' O ' ' C ' ' A' ' 56' ' ' GLY . 2.5 pp -86.9 0.94 54.14 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.228 -0.92 . . . . 0.0 109.492 179.718 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.591 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . 44.17 -121.8 4.06 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 -179.743 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -110.01 31.71 7.27 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.595 -1.402 . . . . 0.0 109.595 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 38.2 t -87.82 -21.11 25.25 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.228 -1.16 . . . . 0.0 109.458 -179.579 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 63.8 mmm -139.07 130.39 26.93 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.173 -0.954 . . . . 0.0 109.454 -179.64 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 63.0 t0 -90.79 106.38 18.47 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.272 -0.893 . . . . 0.0 109.479 179.191 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.416 ' O ' ' C ' ' A' ' 62' ' ' SER . 98.6 mt -93.47 4.44 53.95 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.23 -0.919 . . . . 0.0 109.487 -179.308 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.416 ' C ' ' O ' ' A' ' 61' ' ' LEU . 39.7 t -42.9 -39.71 2.66 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.285 -0.884 . . . . 0.0 109.484 179.577 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 67.9 p -98.57 48.39 0.98 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.238 -0.914 . . . . 0.0 109.417 179.345 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -124.25 131.0 53.5 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.299 -0.875 . . . . 0.0 109.482 -179.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.459 ' CG ' ' OG1' ' A' ' 68' ' ' THR . 55.7 t0 -89.94 104.59 17.14 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.125 -0.984 . . . . 0.0 109.463 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.709 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 68.2 t80 -74.16 -49.34 24.04 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.195 -0.94 . . . . 0.0 109.501 -179.231 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 19.0 mmm180 -51.43 -37.6 49.45 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.171 -0.956 . . . . 0.0 109.449 -179.624 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.459 ' OG1' ' CG ' ' A' ' 65' ' ' ASP . 22.3 p -100.45 -11.21 20.38 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.265 -0.897 . . . . 0.0 109.481 -179.881 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 62.12 34.23 88.37 Favored Glycine 0 N--CA 1.491 2.361 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 179.768 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 62.0 mttp -127.86 147.38 50.45 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.215 -1.167 . . . . 0.0 109.475 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 3.6 tpt -77.87 140.26 39.32 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.184 -0.947 . . . . 0.0 109.513 179.774 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 60.4 tp . . . . . 0 N--CA 1.49 1.548 0 O-C-N 121.222 -0.924 . . . . 0.0 109.458 179.87 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.529 4.869 0 N-CA-C 119.449 2.54 . . . . 0.0 119.449 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.458 ' O ' ' C ' ' A' ' 3' ' ' MET . 22.3 t -65.53 146.5 54.78 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.277 -1.131 . . . . 0.0 109.474 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.458 ' C ' ' O ' ' A' ' 2' ' ' SER . 5.3 ttt 41.04 -157.83 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.217 -0.927 . . . . 0.0 109.454 -179.783 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.433 ' H ' ' HG2' ' A' ' 3' ' ' MET . 96.9 mt-10 -145.17 93.3 2.37 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.274 -0.891 . . . . 0.0 109.523 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 88.1 mtm180 -87.13 141.02 28.96 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.232 -0.917 . . . . 0.0 109.446 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.44 ' CD ' ' N ' ' A' ' 6' ' ' LYS . 11.3 mptt -76.06 139.97 41.67 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.365 -0.835 . . . . 0.0 109.521 179.742 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -157.44 92.3 1.22 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.265 -0.897 . . . . 0.0 109.508 -179.558 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.619 ' HE1' ' HE ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -122.27 149.22 44.01 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.19 -0.944 . . . . 0.0 109.509 179.304 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -62.7 150.83 40.04 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.276 -0.89 . . . . 0.0 109.505 179.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.448 ' SG ' ' C ' ' A' ' 18' ' ' GLU . 10.9 m -93.45 114.3 62.51 Favored Pre-proline 0 N--CA 1.492 1.644 0 O-C-N 121.251 -0.906 . . . . 0.0 109.517 -179.644 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -76.87 -39.4 0.65 Allowed 'Trans proline' 0 C--N 1.306 -1.689 0 C-N-CA 122.821 2.347 . . . . 0.0 112.233 179.389 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.17 -36.39 82.98 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.211 -0.931 . . . . 0.0 109.554 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.595 ' CD2' ' N ' ' A' ' 13' ' ' LEU . 3.4 mm? -88.23 156.91 51.26 Favored Pre-proline 0 N--CA 1.49 1.555 0 O-C-N 121.17 -0.956 . . . . 0.0 109.452 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -52.2 142.79 44.61 Favored 'Trans proline' 0 C--N 1.306 -1.692 0 C-N-CA 122.802 2.334 . . . . 0.0 112.154 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 98.5 mm-40 -47.09 131.96 12.36 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.189 -0.944 . . . . 0.0 109.465 -179.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 120.61 -21.65 8.47 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 179.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 18.1 m95 -84.47 147.89 26.84 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.133 -1.216 . . . . 0.0 109.473 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.448 ' C ' ' SG ' ' A' ' 10' ' ' CYS . 94.1 mt-10 -127.51 148.14 50.32 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.274 -0.891 . . . . 0.0 109.42 -178.679 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.631 ' NH1' ' O ' ' A' ' 68' ' ' THR . 52.0 ttp180 -130.83 126.22 35.69 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.249 -0.907 . . . . 0.0 109.474 179.51 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -129.63 139.03 51.53 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.227 -0.921 . . . . 0.0 109.499 -179.537 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.44 ' H ' ' HB2' ' A' ' 6' ' ' LYS . 77.9 tt0 -101.51 145.63 28.74 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.325 -0.859 . . . . 0.0 109.362 179.06 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.5 t -142.56 121.82 7.74 Favored Pre-proline 0 N--CA 1.49 1.572 0 O-C-N 121.115 -0.991 . . . . 0.0 109.54 -179.159 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -78.73 144.57 19.59 Favored 'Trans proline' 0 C--N 1.305 -1.755 0 C-N-CA 122.797 2.331 . . . . 0.0 112.161 178.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.772 ' H ' ' NE ' ' A' ' 24' ' ' ARG . 0.0 OUTLIER -91.52 176.01 6.7 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.181 -0.949 . . . . 0.0 109.489 179.563 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 95.9 mtt-85 -127.06 24.88 6.31 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.207 -0.933 . . . . 0.0 109.502 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.531 ' OG ' ' CB ' ' A' ' 29' ' ' SER . 97.0 p -64.86 161.61 17.96 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.286 -0.884 . . . . 0.0 109.468 -179.732 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -62.25 -96.78 0.01 OUTLIER Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.515 -1.434 . . . . 0.0 109.515 -179.568 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.577 ' C ' ' H ' ' A' ' 30' ' ' ALA . 96.7 mt -65.21 -34.73 79.06 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.299 -1.118 . . . . 0.0 109.553 -178.592 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.571 ' OG ' ' O ' ' A' ' 29' ' ' SER . 0.3 OUTLIER -70.96 21.92 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.241 -0.912 . . . . 0.0 109.443 -179.007 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.577 ' H ' ' C ' ' A' ' 28' ' ' LEU . . . -79.57 164.35 23.92 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.195 -0.94 . . . . 0.0 109.491 179.884 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.71 ' H ' ' NH1' ' A' ' 24' ' ' ARG . . . 86.7 -17.37 40.59 Favored Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.487 -1.445 . . . . 0.0 109.487 179.565 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . 0.595 ' O ' ' NE ' ' A' ' 24' ' ' ARG . 75.7 m80 -79.25 126.35 30.67 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.259 -1.142 . . . . 0.0 109.395 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 7.4 mtp180 -112.08 118.82 36.46 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.218 -0.927 . . . . 0.0 109.492 179.554 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -91.96 139.49 30.6 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.235 -0.916 . . . . 0.0 109.394 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.6 t -106.7 123.03 61.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.271 -0.893 . . . . 0.0 109.405 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -107.36 140.61 40.02 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.208 -0.933 . . . . 0.0 109.47 179.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.544 ' CD1' ' CE1' ' A' ' 66' ' ' PHE . 71.9 m-85 -109.4 142.25 40.62 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.251 -0.906 . . . . 0.0 109.471 -179.216 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 80.2 m-85 -126.39 139.29 53.39 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.242 -0.911 . . . . 0.0 109.496 -179.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.409 ' CB ' ' HD2' ' A' ' 40' ' ' PRO . 0.4 OUTLIER -99.7 165.22 15.07 Favored Pre-proline 0 N--CA 1.49 1.568 0 O-C-N 121.362 -0.836 . . . . 0.0 109.443 179.53 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.409 ' HD2' ' CB ' ' A' ' 39' ' ' SER . 20.5 Cg_endo -60.47 -19.1 57.59 Favored 'Trans proline' 0 C--N 1.305 -1.747 0 C-N-CA 122.805 2.337 . . . . 0.0 112.201 179.833 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 56.7 p -88.52 0.04 56.73 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.361 -0.837 . . . . 0.0 109.511 179.411 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 85.6 13.11 70.91 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -78.21 117.66 19.7 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.204 -1.174 . . . . 0.0 109.479 -179.773 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.687 ' NZ ' HH11 ' A' ' 46' ' ' ARG . 62.8 tttm -92.81 128.37 38.64 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.295 -0.878 . . . . 0.0 109.402 178.689 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.635 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 1.1 p90 -140.24 146.8 39.12 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.202 -0.936 . . . . 0.0 109.479 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.687 HH11 ' NZ ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -141.7 59.78 1.49 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.218 -0.926 . . . . 0.0 109.525 179.008 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.1 t -157.73 144.97 18.29 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.231 -0.918 . . . . 0.0 109.568 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.603 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 3.8 tttt -68.5 -46.06 36.23 Favored Pre-proline 0 N--CA 1.49 1.575 0 O-C-N 121.176 -0.953 . . . . 0.0 109.437 -179.355 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.603 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 45.6 Cg_exo -55.77 -46.72 29.59 Favored 'Trans proline' 0 C--N 1.306 -1.695 0 C-N-CA 122.77 2.314 . . . . 0.0 112.23 -179.689 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -67.16 -39.94 86.57 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.208 -0.933 . . . . 0.0 109.447 179.794 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 57.0 tp -64.87 -45.81 84.44 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.252 -0.905 . . . . 0.0 109.497 -179.476 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.691 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -69.98 -45.3 67.63 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.271 -0.893 . . . . 0.0 109.474 -179.288 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 77.5 ttt-85 -60.18 -43.52 95.78 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.2 -0.938 . . . . 0.0 109.545 -179.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 37.5 t80 -62.43 -55.61 26.06 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.293 -0.879 . . . . 0.0 109.518 -179.114 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.623 ' CA ' ' HG ' ' A' ' 58' ' ' SER . 96.4 mt -90.34 4.92 49.4 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.202 -0.936 . . . . 0.0 109.532 179.885 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.691 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -48.6 -77.37 0.12 Allowed Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 -179.643 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.09 7.47 0.2 Allowed Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 -179.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.623 ' HG ' ' CA ' ' A' ' 55' ' ' LEU . 3.6 p -108.77 -26.85 10.09 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.209 -1.171 . . . . 0.0 109.498 -179.61 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.408 ' N ' ' O ' ' A' ' 55' ' ' LEU . 18.1 ptm -176.2 170.13 2.68 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.192 -0.942 . . . . 0.0 109.431 -179.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.518 ' O ' ' OD1' ' A' ' 60' ' ' ASP . 45.3 p-10 -97.24 116.47 29.51 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.317 -0.865 . . . . 0.0 109.452 179.655 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 88.5 mt -111.8 16.45 20.45 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.352 -0.843 . . . . 0.0 109.463 -179.414 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 41.0 t -58.77 -39.28 80.57 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.284 -0.885 . . . . 0.0 109.436 -179.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 51.7 p -92.03 23.98 3.48 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.357 -0.84 . . . . 0.0 109.413 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 46.5 t80 -99.72 125.71 45.65 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.248 -0.907 . . . . 0.0 109.476 -179.729 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.465 ' OD2' ' OG1' ' A' ' 68' ' ' THR . 55.3 t0 -83.63 119.31 24.6 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.261 -0.899 . . . . 0.0 109.418 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.544 ' CE1' ' CD1' ' A' ' 37' ' ' TYR . 73.8 t80 -83.02 -33.23 26.55 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.235 -0.916 . . . . 0.0 109.541 -179.541 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 42.3 ttm180 -66.18 -43.94 85.43 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.264 -0.897 . . . . 0.0 109.529 -179.214 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.631 ' O ' ' NH1' ' A' ' 19' ' ' ARG . 11.3 p -96.47 -15.91 21.45 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.278 -0.889 . . . . 0.0 109.503 -179.867 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.515 ' HA3' HH11 ' A' ' 19' ' ' ARG . . . 64.52 60.45 7.02 Favored Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.497 -1.441 . . . . 0.0 109.497 179.375 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -152.96 149.74 28.52 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.318 -1.107 . . . . 0.0 109.423 179.599 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 34.6 ttm -91.63 121.41 33.27 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.208 -0.932 . . . . 0.0 109.522 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 3.4 tt . . . . . 0 N--CA 1.491 1.598 0 O-C-N 121.278 -0.889 . . . . 0.0 109.458 -179.849 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.527 4.736 0 N-CA-C 119.538 2.575 . . . . 0.0 119.538 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 54.6 p -148.15 -157.69 0.84 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.219 -1.165 . . . . 0.0 109.462 179.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 72.5 mtm -72.87 101.87 3.27 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.334 -0.854 . . . . 0.0 109.445 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.604 ' O ' ' C ' ' A' ' 5' ' ' ARG . 96.4 mt-10 -96.61 165.3 12.21 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.257 -0.902 . . . . 0.0 109.502 179.712 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.604 ' C ' ' O ' ' A' ' 4' ' ' GLU . 5.7 ptp180 31.51 95.12 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.19 -0.944 . . . . 0.0 109.451 179.332 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.594 ' NZ ' ' O ' ' A' ' 21' ' ' GLU . 0.3 OUTLIER -120.68 123.35 42.53 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.294 -0.879 . . . . 0.0 109.526 179.948 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 83.7 mtp180 -100.66 108.44 20.32 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.246 -0.909 . . . . 0.0 109.501 -179.306 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 15.2 m0 -104.37 169.71 8.32 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.212 -0.93 . . . . 0.0 109.472 178.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -88.83 146.04 25.21 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.212 -0.93 . . . . 0.0 109.408 -179.661 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 17.8 t -121.34 100.73 44.67 Favored Pre-proline 0 N--CA 1.489 1.484 0 O-C-N 121.247 -0.908 . . . . 0.0 109.499 179.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -53.11 -40.18 77.7 Favored 'Trans proline' 0 C--N 1.304 -1.776 0 C-N-CA 122.864 2.376 . . . . 0.0 112.23 -179.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.42 -28.95 60.9 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.262 -0.899 . . . . 0.0 109.52 -179.725 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 14.5 mt -91.67 151.38 42.31 Favored Pre-proline 0 N--CA 1.49 1.53 0 O-C-N 121.302 -0.874 . . . . 0.0 109.436 -179.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -51.1 154.6 7.34 Favored 'Trans proline' 0 C--N 1.306 -1.709 0 C-N-CA 122.746 2.297 . . . . 0.0 112.256 179.029 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 89.5 mt-30 -58.25 121.02 9.73 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.254 -0.904 . . . . 0.0 109.477 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 124.52 -36.19 2.97 Favored Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 -179.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . 0.416 ' CD1' ' N ' ' A' ' 17' ' ' TRP . 37.5 m95 -74.61 149.02 40.22 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.219 -1.165 . . . . 0.0 109.453 178.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -139.46 153.35 47.53 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.139 -0.976 . . . . 0.0 109.489 -178.437 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.552 ' NH1' ' O ' ' A' ' 68' ' ' THR . 60.8 ttp180 -106.56 156.44 18.58 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.179 -0.951 . . . . 0.0 109.423 178.544 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -142.53 140.53 31.84 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.226 -0.921 . . . . 0.0 109.557 -178.572 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.594 ' O ' ' NZ ' ' A' ' 6' ' ' LYS . 81.2 mm-40 -113.92 121.04 42.74 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.187 -0.945 . . . . 0.0 109.407 178.004 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 39.2 t -128.79 133.78 25.58 Favored Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.215 -0.928 . . . . 0.0 109.609 -178.671 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -76.47 171.45 18.04 Favored 'Trans proline' 0 C--N 1.306 -1.703 0 C-N-CA 122.825 2.35 . . . . 0.0 112.221 178.21 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.548 ' NE ' ' OD2' ' A' ' 34' ' ' ASP . 12.7 mmt85 -105.55 126.86 52.62 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.333 -0.854 . . . . 0.0 109.366 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.752 ' O ' ' C ' ' A' ' 26' ' ' SER . 85.0 mtp180 -106.3 -34.71 7.38 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.112 -0.992 . . . . 0.0 109.512 -179.568 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.752 ' C ' ' O ' ' A' ' 25' ' ' ARG . 81.1 p 4.27 -112.17 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.241 -0.912 . . . . 0.0 109.477 -179.431 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -150.99 -94.69 0.11 Allowed Glycine 0 N--CA 1.49 2.235 0 N-CA-C 109.621 -1.392 . . . . 0.0 109.621 179.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 56.2 tp -68.28 -46.55 70.06 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.226 -1.161 . . . . 0.0 109.414 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 37.7 t -70.61 -10.19 58.73 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.322 -0.862 . . . . 0.0 109.429 -179.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.01 147.89 4.75 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.26 -0.9 . . . . 0.0 109.459 179.589 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 124.37 -34.23 3.57 Favored Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 36.2 m80 -73.89 169.48 17.32 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.247 -1.149 . . . . 0.0 109.454 178.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 19.1 ptp180 -128.94 150.75 50.25 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.212 -0.93 . . . . 0.0 109.493 -179.491 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.548 ' OD2' ' NE ' ' A' ' 24' ' ' ARG . 69.5 m-20 -129.68 146.24 51.47 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.264 -0.897 . . . . 0.0 109.454 179.497 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 33.3 t -105.06 132.4 51.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.225 -0.922 . . . . 0.0 109.446 -179.258 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 81.3 m-85 -122.75 152.45 40.61 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.161 -0.962 . . . . 0.0 109.505 179.137 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 68.0 m-85 -123.87 149.29 45.97 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.193 -0.942 . . . . 0.0 109.49 -179.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 53.5 m-85 -116.08 128.19 55.48 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.263 -0.898 . . . . 0.0 109.643 -179.397 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.535 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.5 OUTLIER -92.61 -177.94 0.8 Allowed Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.299 -0.876 . . . . 0.0 109.444 179.195 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.535 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 51.2 Cg_exo -55.37 -31.44 77.36 Favored 'Trans proline' 0 C--N 1.305 -1.746 0 C-N-CA 122.885 2.39 . . . . 0.0 112.248 -179.544 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.46 ' O ' ' OG ' ' A' ' 41' ' ' SER . 0.1 OUTLIER -93.05 11.81 26.28 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.184 -0.947 . . . . 0.0 109.528 179.019 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 73.66 14.85 79.54 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 -179.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.506 ' HZ2' HE21 ' A' ' 50' ' ' GLN . 5.6 ttmt -64.36 128.73 37.05 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.175 -1.191 . . . . 0.0 109.44 -179.504 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 9.8 mtpm? -94.45 118.09 31.12 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.282 -0.886 . . . . 0.0 109.455 178.685 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 55.0 p90 -139.4 146.21 39.89 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.284 -0.885 . . . . 0.0 109.44 -179.638 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 26.6 ptt180 -126.32 57.78 1.39 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.336 -0.852 . . . . 0.0 109.493 179.345 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.5 t -150.45 130.33 13.33 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.236 -0.915 . . . . 0.0 109.504 179.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.863 ' N ' ' HD2' ' A' ' 49' ' ' PRO . 7.6 tmtt? -63.48 -46.81 84.17 Favored Pre-proline 0 N--CA 1.49 1.533 0 O-C-N 121.222 -0.924 . . . . 0.0 109.503 -179.915 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.863 ' HD2' ' N ' ' A' ' 48' ' ' LYS . 18.3 Cg_endo -57.95 -37.08 97.43 Favored 'Trans proline' 0 C--N 1.305 -1.734 0 C-N-CA 122.812 2.341 . . . . 0.0 112.235 178.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.506 HE21 ' HZ2' ' A' ' 43' ' ' LYS . 59.2 tt0 -67.66 -38.28 83.57 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.207 -0.933 . . . . 0.0 109.478 179.277 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 2.0 tt -63.64 -42.32 98.14 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.26 -0.9 . . . . 0.0 109.505 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.89 -39.75 90.94 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.28 -0.888 . . . . 0.0 109.491 -179.551 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 13.6 tpp180 -55.9 -45.98 78.48 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.254 -0.904 . . . . 0.0 109.521 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . 0.434 ' C ' ' H ' ' A' ' 56' ' ' GLY . 31.8 t80 -62.59 -47.87 81.9 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.24 -0.913 . . . . 0.0 109.484 179.537 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 8.1 mp -65.26 -0.59 1.84 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.291 -0.88 . . . . 0.0 109.437 179.504 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.551 ' O ' ' C ' ' A' ' 57' ' ' GLY . . . 56.37 60.36 9.09 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.616 -1.394 . . . . 0.0 109.616 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . 0.551 ' C ' ' O ' ' A' ' 56' ' ' GLY . . . 34.34 38.41 0.11 Allowed Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 -179.351 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.468 ' N ' ' O ' ' A' ' 56' ' ' GLY . 89.0 p -88.95 -0.89 57.79 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.294 -1.121 . . . . 0.0 109.436 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 33.1 ttp -155.46 148.74 24.82 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.224 -0.922 . . . . 0.0 109.548 -179.736 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 55.1 t0 -85.76 101.81 13.11 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.232 -0.917 . . . . 0.0 109.482 -179.585 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 89.1 mt -96.41 1.18 51.47 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.258 -0.901 . . . . 0.0 109.449 179.56 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 58.6 m -54.93 -27.19 41.49 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.143 -0.973 . . . . 0.0 109.458 179.585 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 36.1 p -94.11 1.46 56.13 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.27 -0.894 . . . . 0.0 109.547 179.563 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.424 ' CZ ' ' HA2' ' A' ' 69' ' ' GLY . 72.9 t80 -87.87 114.52 24.56 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.247 -0.908 . . . . 0.0 109.512 179.459 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -76.23 136.81 39.69 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.268 -0.895 . . . . 0.0 109.465 -179.498 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 69.4 t80 -89.15 -37.34 15.13 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.144 -0.972 . . . . 0.0 109.44 179.446 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 29.0 tpt85 -59.35 -44.44 92.67 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.278 -0.889 . . . . 0.0 109.461 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.552 ' O ' ' NH1' ' A' ' 19' ' ' ARG . 33.1 p -97.54 -20.53 17.65 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.324 -0.86 . . . . 0.0 109.485 179.659 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.449 ' HA3' HH11 ' A' ' 19' ' ' ARG . . . 67.21 31.46 77.47 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.56 -1.416 . . . . 0.0 109.56 179.667 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 64.6 mttp -132.11 152.58 51.15 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.232 -1.157 . . . . 0.0 109.525 -179.655 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 17.4 mtt -78.73 144.53 35.16 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.211 -0.931 . . . . 0.0 109.466 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.456 ' CD2' ' C ' ' A' ' 72' ' ' LEU . 5.1 tt . . . . . 0 N--CA 1.49 1.564 0 O-C-N 121.213 -0.929 . . . . 0.0 109.413 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.529 4.879 0 N-CA-C 119.384 2.513 . . . . 0.0 119.384 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 86.5 p -89.17 -1.48 58.11 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.214 -1.168 . . . . 0.0 109.536 179.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 81.4 mmm 46.18 -144.88 0.22 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.248 -0.907 . . . . 0.0 109.456 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.572 ' O ' ' O ' ' A' ' 5' ' ' ARG . 15.9 pt-20 -93.26 34.58 1.13 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.329 -0.857 . . . . 0.0 109.442 -179.187 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.584 ' NH2' ' OE2' ' A' ' 20' ' ' GLU . 50.0 mtp180 57.45 139.55 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.182 -0.949 . . . . 0.0 109.479 179.625 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.404 ' HD2' ' N ' ' A' ' 6' ' ' LYS . 10.9 mptt -74.68 158.29 33.84 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.304 -0.872 . . . . 0.0 109.452 -179.0 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 79.8 mtp180 -150.92 140.26 21.37 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.246 -0.909 . . . . 0.0 109.456 -179.171 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.589 ' CD1' ' N ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -167.75 140.88 3.31 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.228 -0.92 . . . . 0.0 109.389 179.213 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -87.68 136.13 33.08 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.168 -0.957 . . . . 0.0 109.465 178.586 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 32.8 m -94.03 141.05 23.16 Favored Pre-proline 0 N--CA 1.489 1.511 0 O-C-N 121.149 -0.969 . . . . 0.0 109.505 -179.701 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -70.27 -14.81 34.89 Favored 'Trans proline' 0 C--N 1.304 -1.773 0 C-N-CA 122.893 2.396 . . . . 0.0 112.249 179.713 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -90.78 -11.71 38.64 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.206 -0.934 . . . . 0.0 109.483 179.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 7.7 mp -99.71 148.95 35.46 Favored Pre-proline 0 N--CA 1.49 1.553 0 O-C-N 121.183 -0.948 . . . . 0.0 109.456 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.404 ' HG2' ' CD1' ' A' ' 17' ' ' TRP . 47.2 Cg_endo -70.21 148.88 63.15 Favored 'Trans proline' 0 C--N 1.305 -1.738 0 C-N-CA 122.858 2.372 . . . . 0.0 112.213 178.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -52.97 129.31 30.12 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.313 -0.867 . . . . 0.0 109.52 -179.463 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 122.84 -25.09 6.56 Favored Glycine 0 N--CA 1.489 2.211 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 179.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . 0.434 ' CD1' ' N ' ' A' ' 17' ' ' TRP . 14.1 m95 -86.76 152.11 22.8 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.226 -1.161 . . . . 0.0 109.479 179.652 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -129.48 147.13 51.26 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.165 -0.96 . . . . 0.0 109.545 -179.422 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.553 ' NH1' ' NE1' ' A' ' 8' ' ' TRP . 75.0 ttt-85 -128.23 125.74 39.55 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.231 -0.918 . . . . 0.0 109.432 179.581 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.588 ' OE2' ' CE1' ' A' ' 38' ' ' TYR . 21.8 pt-20 -134.1 139.34 45.87 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.201 -0.937 . . . . 0.0 109.461 -179.553 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -101.55 151.3 22.14 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.278 -0.888 . . . . 0.0 109.4 -179.778 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.1 t -136.14 122.52 13.99 Favored Pre-proline 0 N--CA 1.491 1.578 0 O-C-N 121.226 -0.921 . . . . 0.0 109.518 -179.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . 0.414 ' CB ' ' NH1' ' A' ' 33' ' ' ARG . 62.0 Cg_endo -77.01 140.14 19.88 Favored 'Trans proline' 0 C--N 1.306 -1.689 0 C-N-CA 122.814 2.342 . . . . 0.0 112.109 -178.766 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.416 HH11 ' HB2' ' A' ' 29' ' ' SER . 38.5 ttm180 -89.9 168.04 12.35 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.157 -0.964 . . . . 0.0 109.522 178.5 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.612 ' O ' ' O ' ' A' ' 26' ' ' SER . 90.8 mtm180 -119.06 -139.18 0.35 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.269 -0.894 . . . . 0.0 109.475 -178.832 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.612 ' O ' ' O ' ' A' ' 25' ' ' ARG . 12.6 p -38.14 166.06 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.248 -0.907 . . . . 0.0 109.496 -179.391 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 108.91 153.15 15.56 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 -179.127 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.584 ' C ' ' H ' ' A' ' 30' ' ' ALA . 95.0 mt -59.43 -41.74 90.26 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.33 -1.1 . . . . 0.0 109.458 -179.752 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.432 ' C ' ' HD1' ' A' ' 32' ' ' HIS . 2.9 m -70.78 30.38 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.185 -0.947 . . . . 0.0 109.458 178.846 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.584 ' H ' ' C ' ' A' ' 28' ' ' LEU . . . -66.36 150.71 48.46 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.236 -0.915 . . . . 0.0 109.405 -179.77 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 78.65 -17.72 6.49 Favored Glycine 0 N--CA 1.49 2.268 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . 0.636 ' C ' ' HE ' ' A' ' 33' ' ' ARG . 58.4 m80 -71.4 131.73 43.79 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.352 -1.087 . . . . 0.0 109.496 179.773 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.636 ' HE ' ' C ' ' A' ' 32' ' ' HIS . 0.4 OUTLIER -107.49 107.82 18.85 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.252 -0.905 . . . . 0.0 109.481 -179.261 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.511 ' OD1' ' N ' ' A' ' 35' ' ' VAL . 58.4 t0 -77.8 134.94 37.91 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.303 -0.873 . . . . 0.0 109.505 179.41 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.511 ' N ' ' OD1' ' A' ' 34' ' ' ASP . 47.1 t -105.45 128.13 59.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.247 -0.908 . . . . 0.0 109.47 -179.796 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.418 ' CZ ' ' OD2' ' A' ' 34' ' ' ASP . 72.7 m-85 -115.14 142.89 46.05 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.172 -0.955 . . . . 0.0 109.427 179.251 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 52.8 m-85 -111.22 142.73 43.03 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.273 -0.892 . . . . 0.0 109.462 -179.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.588 ' CE1' ' OE2' ' A' ' 20' ' ' GLU . 19.9 m-85 -118.14 135.85 53.97 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.251 -0.905 . . . . 0.0 109.445 179.793 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.438 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -94.26 176.88 2.13 Favored Pre-proline 0 N--CA 1.49 1.551 0 O-C-N 121.231 -0.918 . . . . 0.0 109.474 179.55 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.438 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 42.1 Cg_exo -55.47 -29.88 71.07 Favored 'Trans proline' 0 C--N 1.304 -1.795 0 C-N-CA 122.897 2.398 . . . . 0.0 112.243 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 66.8 m -91.05 -2.29 57.67 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.176 -0.952 . . . . 0.0 109.548 -179.396 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 88.32 22.1 42.27 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.556 -1.418 . . . . 0.0 109.556 179.748 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.423 ' HE3' HE22 ' A' ' 50' ' ' GLN . 46.9 tttp -75.06 129.13 37.08 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.273 -1.133 . . . . 0.0 109.421 -179.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 47.5 mtpt -94.27 120.87 35.14 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.263 -0.898 . . . . 0.0 109.531 179.301 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.599 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 2.0 p90 -141.68 150.63 42.13 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.197 -0.939 . . . . 0.0 109.389 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 10.6 ptm180 -143.04 68.94 1.3 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.331 -0.855 . . . . 0.0 109.453 179.194 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -148.1 129.45 14.77 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.179 -0.951 . . . . 0.0 109.439 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.639 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -61.2 -42.95 88.52 Favored Pre-proline 0 N--CA 1.488 1.448 0 O-C-N 121.209 -0.932 . . . . 0.0 109.461 -179.33 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.639 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 32.0 Cg_exo -58.2 -40.26 77.93 Favored 'Trans proline' 0 C--N 1.305 -1.752 0 C-N-CA 122.845 2.363 . . . . 0.0 112.242 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.423 HE22 ' HE3' ' A' ' 43' ' ' LYS . 59.5 tt0 -65.79 -38.86 90.15 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.29 -0.881 . . . . 0.0 109.516 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 8.9 mp -65.29 -45.53 84.04 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.223 -0.923 . . . . 0.0 109.46 -179.667 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.667 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -72.35 -48.08 44.64 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.337 -0.852 . . . . 0.0 109.515 -179.379 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 80.1 mtp180 -58.9 -32.52 69.59 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.203 -0.936 . . . . 0.0 109.473 -179.413 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 24.2 t80 -86.01 -55.08 4.11 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.301 -0.875 . . . . 0.0 109.446 -178.55 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.404 ' O ' ' C ' ' A' ' 56' ' ' GLY . 95.2 mt -93.85 6.2 49.18 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.263 -0.898 . . . . 0.0 109.411 -178.217 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.667 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -45.55 -72.29 0.39 Allowed Glycine 0 N--CA 1.492 2.374 0 N-CA-C 109.475 -1.45 . . . . 0.0 109.475 -179.599 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -57.41 -43.7 93.82 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 -179.016 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 54.1 p -58.2 -34.64 70.59 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.243 -1.151 . . . . 0.0 109.44 -179.344 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.404 ' N ' ' O ' ' A' ' 55' ' ' LEU . 1.7 mmm -170.53 162.82 8.23 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.33 -0.856 . . . . 0.0 109.472 -179.61 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 56.2 t0 -95.42 114.69 26.48 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.238 -0.914 . . . . 0.0 109.499 179.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 97.0 mt -106.67 3.13 26.43 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.277 -0.89 . . . . 0.0 109.501 -179.073 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.455 ' HG ' ' N ' ' A' ' 63' ' ' THR . 78.7 p -52.75 -36.76 58.36 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.263 -0.898 . . . . 0.0 109.408 -179.758 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' THR . . . . . 0.455 ' N ' ' HG ' ' A' ' 62' ' ' SER . 54.3 p -81.17 14.45 2.34 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.273 -0.892 . . . . 0.0 109.457 179.894 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.625 ' O ' ' NZ ' ' A' ' 48' ' ' LYS . 47.0 t80 -88.75 133.15 34.33 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.255 -0.903 . . . . 0.0 109.402 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.499 ' O ' ' N ' ' A' ' 69' ' ' GLY . 64.4 t0 -82.87 114.11 20.95 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.299 -0.876 . . . . 0.0 109.48 -179.734 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 64.0 t80 -75.02 -44.89 45.4 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.249 -0.907 . . . . 0.0 109.477 -179.068 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.61 -46.09 84.52 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.314 -0.866 . . . . 0.0 109.459 -179.214 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.534 ' O ' ' NH2' ' A' ' 19' ' ' ARG . 43.3 p -94.71 -13.45 25.74 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.245 -0.91 . . . . 0.0 109.486 -179.836 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.499 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 61.72 40.23 98.5 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 179.732 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -137.75 157.21 46.92 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.267 -1.137 . . . . 0.0 109.468 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 3.0 ttt -84.6 122.97 29.8 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.197 -0.939 . . . . 0.0 109.422 -179.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 7.2 tt . . . . . 0 N--CA 1.49 1.572 0 O-C-N 121.334 -0.854 . . . . 0.0 109.449 -179.908 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.529 4.88 0 N-CA-C 119.437 2.535 . . . . 0.0 119.437 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.4 m -74.07 150.25 40.68 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.315 -1.109 . . . . 0.0 109.577 179.618 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.442 ' O ' ' C ' ' A' ' 4' ' ' GLU . 66.6 mtt 50.9 -169.8 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.279 -0.888 . . . . 0.0 109.464 -179.951 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.442 ' C ' ' O ' ' A' ' 3' ' ' MET . 83.9 tt0 42.65 88.16 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.348 -0.845 . . . . 0.0 109.446 -179.974 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.425 ' N ' ' OE2' ' A' ' 20' ' ' GLU . 8.3 tpm_? -71.21 -110.3 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.283 -0.886 . . . . 0.0 109.411 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.414 ' N ' ' HG3' ' A' ' 5' ' ' ARG . 7.4 ptmt -115.98 109.81 18.08 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.196 -0.94 . . . . 0.0 109.496 179.465 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -120.88 133.61 55.3 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.22 -0.925 . . . . 0.0 109.493 -179.424 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.413 ' HB2' ' HE ' ' A' ' 19' ' ' ARG . 2.0 m0 -129.82 175.97 8.41 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.232 -0.918 . . . . 0.0 109.502 179.879 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 -75.38 143.39 42.81 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.258 -0.902 . . . . 0.0 109.417 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.2 t -101.93 108.5 56.65 Favored Pre-proline 0 N--CA 1.49 1.575 0 O-C-N 121.259 -0.901 . . . . 0.0 109.448 179.703 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -77.01 -14.99 16.69 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 C-N-CA 122.891 2.394 . . . . 0.0 112.226 -179.223 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -71.39 -40.33 70.62 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.274 -0.891 . . . . 0.0 109.402 -179.746 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.517 ' CB ' ' CD ' ' A' ' 14' ' ' PRO . 0.3 OUTLIER -96.19 -179.59 0.95 Allowed Pre-proline 0 N--CA 1.49 1.527 0 O-C-N 121.236 -0.915 . . . . 0.0 109.433 -179.947 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.517 ' CD ' ' CB ' ' A' ' 13' ' ' LEU . 33.6 Cg_exo -60.34 145.91 97.67 Favored 'Trans proline' 0 C--N 1.306 -1.701 0 C-N-CA 122.786 2.324 . . . . 0.0 112.247 -179.481 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 19.2 mm100 -51.79 128.85 24.94 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.175 -0.953 . . . . 0.0 109.524 -179.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 123.96 -24.17 6.41 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.626 -1.39 . . . . 0.0 109.626 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 31.0 m95 -84.16 145.91 28.13 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.28 -1.129 . . . . 0.0 109.483 179.308 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -138.42 154.93 48.89 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.228 -0.92 . . . . 0.0 109.527 -179.458 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.523 ' CD ' ' H ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -126.59 162.17 26.32 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.294 -0.879 . . . . 0.0 109.474 179.252 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.425 ' OE2' ' N ' ' A' ' 5' ' ' ARG . 78.0 tt0 -143.22 144.55 32.2 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.219 -0.925 . . . . 0.0 109.48 -179.004 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -113.07 132.68 55.32 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.192 -0.942 . . . . 0.0 109.387 179.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.5 t -127.53 108.95 20.89 Favored Pre-proline 0 N--CA 1.491 1.589 0 O-C-N 121.217 -0.927 . . . . 0.0 109.609 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -74.53 142.72 29.84 Favored 'Trans proline' 0 C--N 1.305 -1.713 0 C-N-CA 122.811 2.341 . . . . 0.0 112.127 -178.557 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.546 ' NE ' ' HG ' ' A' ' 29' ' ' SER . 80.6 mtp85 -97.78 172.27 7.79 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.189 -0.944 . . . . 0.0 109.448 179.059 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.497 ' O ' ' OG ' ' A' ' 26' ' ' SER . 59.8 ttp180 -174.44 62.88 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.252 -0.905 . . . . 0.0 109.476 -179.416 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.497 ' OG ' ' O ' ' A' ' 25' ' ' ARG . 1.6 m 168.32 78.75 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.206 -0.934 . . . . 0.0 109.516 179.25 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 143.54 178.87 19.7 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 179.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.591 ' C ' ' H ' ' A' ' 30' ' ' ALA . 3.9 mm? -60.61 -40.4 91.73 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.303 -1.116 . . . . 0.0 109.435 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.546 ' HG ' ' NE ' ' A' ' 24' ' ' ARG . 78.9 p -70.39 29.67 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.267 -0.896 . . . . 0.0 109.422 179.805 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.591 ' H ' ' C ' ' A' ' 28' ' ' LEU . . . -66.35 146.73 54.25 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.26 -0.9 . . . . 0.0 109.455 179.703 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 78.95 -14.83 12.02 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 78.5 m80 -86.11 130.74 34.43 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.215 -1.168 . . . . 0.0 109.375 179.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 36.2 ptt-85 -112.26 132.77 54.76 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.203 -0.935 . . . . 0.0 109.56 -179.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -87.88 142.24 27.96 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.266 -0.896 . . . . 0.0 109.475 179.289 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 59.6 t -112.72 125.74 70.02 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.317 -0.865 . . . . 0.0 109.496 179.91 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 84.0 m-85 -112.98 144.28 42.83 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.238 -0.913 . . . . 0.0 109.518 179.11 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.668 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 49.9 m-85 -112.71 148.46 34.66 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.233 -0.917 . . . . 0.0 109.455 -179.786 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.569 ' CD1' ' N ' ' A' ' 38' ' ' TYR . 3.1 m-85 -127.88 140.37 52.06 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.312 -0.867 . . . . 0.0 109.609 -179.934 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.431 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -96.21 176.64 2.07 Favored Pre-proline 0 N--CA 1.491 1.606 0 O-C-N 121.214 -0.929 . . . . 0.0 109.467 179.775 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.431 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 53.1 Cg_exo -54.29 -30.13 60.86 Favored 'Trans proline' 0 C--N 1.305 -1.728 0 C-N-CA 122.797 2.332 . . . . 0.0 112.252 179.568 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 11.7 t -88.0 -3.27 58.93 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.248 -0.908 . . . . 0.0 109.477 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 87.61 21.97 45.39 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.549 -1.421 . . . . 0.0 109.549 -179.673 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 61.6 tttp -73.57 123.76 24.59 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.306 -1.114 . . . . 0.0 109.452 -179.668 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -90.8 121.59 32.8 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.267 -0.895 . . . . 0.0 109.443 179.331 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.447 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 8.9 p90 -141.07 148.17 39.75 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.21 -0.931 . . . . 0.0 109.511 179.763 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -142.31 70.61 1.33 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.207 -0.933 . . . . 0.0 109.49 179.137 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.5 p -158.67 144.44 16.68 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.296 -0.877 . . . . 0.0 109.423 179.575 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.675 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 12.9 tptt -65.46 -41.71 52.19 Favored Pre-proline 0 N--CA 1.49 1.547 0 O-C-N 121.316 -0.865 . . . . 0.0 109.455 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.675 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 39.0 Cg_exo -57.23 -40.35 83.22 Favored 'Trans proline' 0 C--N 1.306 -1.699 0 C-N-CA 122.839 2.36 . . . . 0.0 112.259 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -68.22 -39.1 82.45 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.202 -0.936 . . . . 0.0 109.46 179.747 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -61.92 -46.34 89.79 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.253 -0.904 . . . . 0.0 109.457 -179.504 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.633 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -73.9 -42.81 60.11 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.339 -0.851 . . . . 0.0 109.452 -179.361 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 75.7 ttt180 -58.59 -47.32 84.72 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.296 -0.877 . . . . 0.0 109.515 -179.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 18.4 t80 -69.8 -53.88 16.19 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.222 -0.924 . . . . 0.0 109.479 -179.454 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.438 ' O ' ' N ' ' A' ' 57' ' ' GLY . 96.0 mt -80.35 0.39 33.27 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.288 -0.883 . . . . 0.0 109.45 -179.142 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.633 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -56.98 89.72 0.01 OUTLIER Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . 0.438 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . 133.18 -1.08 4.49 Favored Glycine 0 N--CA 1.491 2.346 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 -179.885 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 32.2 t -105.23 -31.02 9.3 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.27 -1.135 . . . . 0.0 109.457 179.786 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 3.1 ptp -178.71 176.75 0.94 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.33 -0.856 . . . . 0.0 109.512 -179.831 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -85.86 104.64 15.71 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.214 -0.929 . . . . 0.0 109.436 179.462 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -85.98 -0.89 56.62 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.162 -0.961 . . . . 0.0 109.453 -179.662 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 40.9 t -53.67 -37.64 63.38 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.157 -0.964 . . . . 0.0 109.442 -179.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' THR . . . . . 0.51 ' O ' ' SD ' ' A' ' 71' ' ' MET . 37.8 p -95.23 45.68 1.1 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.207 -0.933 . . . . 0.0 109.43 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 26.3 t80 -121.26 129.86 53.37 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.259 -0.901 . . . . 0.0 109.478 -179.69 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.454 ' O ' ' N ' ' A' ' 69' ' ' GLY . 57.9 t0 -90.2 110.17 21.22 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.266 -0.897 . . . . 0.0 109.418 -179.974 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.668 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 74.6 t80 -77.19 -40.27 45.86 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.233 -0.917 . . . . 0.0 109.445 -179.915 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 26.6 mmt180 -61.07 -39.31 89.4 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.23 -0.919 . . . . 0.0 109.53 -179.609 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.443 ' OG1' ' CG ' ' A' ' 65' ' ' ASP . 34.6 p -100.35 -15.45 17.98 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.27 -0.894 . . . . 0.0 109.516 -179.528 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.454 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 64.21 42.64 97.84 Favored Glycine 0 N--CA 1.491 2.336 0 N-CA-C 109.542 -1.423 . . . . 0.0 109.542 179.661 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.5 tppt? -135.9 143.46 45.01 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.24 -1.153 . . . . 0.0 109.468 179.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.51 ' SD ' ' O ' ' A' ' 63' ' ' THR . 35.8 tpp -85.23 131.72 34.38 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.244 -0.91 . . . . 0.0 109.5 -179.616 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 4.4 tt . . . . . 0 N--CA 1.491 1.588 0 O-C-N 121.177 -0.952 . . . . 0.0 109.442 -179.761 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.528 4.819 0 N-CA-C 119.494 2.557 . . . . 0.0 119.494 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 60.72 9.22 2.08 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.187 -1.184 . . . . 0.0 109.397 179.593 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.475 ' O ' ' N ' ' A' ' 5' ' ' ARG . 26.3 ttt -68.72 101.13 1.26 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.336 -0.853 . . . . 0.0 109.438 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.459 ' C ' ' O ' ' A' ' 3' ' ' MET . 69.9 mm-40 41.12 27.61 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.285 -0.884 . . . . 0.0 109.48 -179.8 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.475 ' N ' ' O ' ' A' ' 3' ' ' MET . 62.9 ttp180 -151.93 102.11 2.8 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.288 -0.883 . . . . 0.0 109.43 -179.876 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 56.7 mttt -74.12 163.27 28.07 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.202 -0.936 . . . . 0.0 109.481 179.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.589 ' O ' ' CD1' ' A' ' 8' ' ' TRP . 15.0 mmt180 -142.38 134.03 26.78 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.248 -0.907 . . . . 0.0 109.499 -178.617 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.589 ' CD1' ' O ' ' A' ' 7' ' ' ARG . 5.8 m0 -159.62 132.81 6.95 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.147 -0.97 . . . . 0.0 109.477 179.831 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -73.62 148.55 42.76 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.251 -0.906 . . . . 0.0 109.465 179.286 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 34.1 t -112.69 100.99 52.11 Favored Pre-proline 0 N--CA 1.488 1.448 0 O-C-N 121.236 -0.915 . . . . 0.0 109.523 -179.585 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_exo -54.2 -29.14 55.18 Favored 'Trans proline' 0 C--N 1.306 -1.705 0 C-N-CA 122.885 2.39 . . . . 0.0 112.204 179.092 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.25 -24.53 66.6 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.334 -0.854 . . . . 0.0 109.502 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.571 ' CD1' ' N ' ' A' ' 13' ' ' LEU . 4.8 mp -96.1 155.84 37.76 Favored Pre-proline 0 N--CA 1.489 1.519 0 O-C-N 121.263 -0.898 . . . . 0.0 109.542 -179.841 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -59.34 143.8 99.61 Favored 'Trans proline' 0 C--N 1.305 -1.719 0 C-N-CA 122.799 2.333 . . . . 0.0 112.182 179.273 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 70.5 tp60 -47.81 129.44 14.2 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.278 -0.889 . . . . 0.0 109.491 179.601 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 119.24 -21.9 9.16 Favored Glycine 0 N--CA 1.489 2.214 0 N-CA-C 109.576 -1.409 . . . . 0.0 109.576 -179.317 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . 0.41 ' N ' ' CD1' ' A' ' 17' ' ' TRP . 15.9 m95 -83.73 151.35 25.28 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.219 -1.165 . . . . 0.0 109.456 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -128.94 146.05 51.06 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.239 -0.913 . . . . 0.0 109.472 -179.394 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 77.8 ttt-85 -127.86 123.87 36.12 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.242 -0.911 . . . . 0.0 109.478 178.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.543 ' OE1' ' CZ ' ' A' ' 7' ' ' ARG . 7.2 pt-20 -131.37 138.92 49.35 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.254 -0.903 . . . . 0.0 109.529 -179.834 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 46.0 tt0 -94.39 143.95 25.97 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.333 -0.854 . . . . 0.0 109.423 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 47.3 t -126.5 135.56 27.41 Favored Pre-proline 0 N--CA 1.49 1.552 0 O-C-N 121.206 -0.933 . . . . 0.0 109.606 -179.257 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . 0.429 ' O ' ' N ' ' A' ' 25' ' ' ARG . 34.9 Cg_endo -65.58 152.21 82.47 Favored 'Trans proline' 0 C--N 1.304 -1.772 0 C-N-CA 122.828 2.352 . . . . 0.0 112.214 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.511 ' CZ ' ' O ' ' A' ' 24' ' ' ARG . 0.6 OUTLIER -59.86 87.88 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.258 -0.901 . . . . 0.0 109.504 -178.992 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.429 ' N ' ' O ' ' A' ' 23' ' ' PRO . 79.5 mtp85 -99.96 103.78 15.36 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.253 -0.904 . . . . 0.0 109.453 178.109 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 4.6 t 63.49 139.7 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.189 -0.944 . . . . 0.0 109.463 -179.767 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 137.97 145.88 4.95 Favored Glycine 0 N--CA 1.489 2.173 0 N-CA-C 109.605 -1.398 . . . . 0.0 109.605 -179.778 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 97.6 mt -72.47 -48.34 41.6 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.229 -1.159 . . . . 0.0 109.48 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.532 ' O ' ' O ' ' A' ' 30' ' ' ALA . 4.4 m -72.03 0.6 9.04 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.253 -0.904 . . . . 0.0 109.496 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.532 ' O ' ' O ' ' A' ' 29' ' ' SER . . . -42.5 170.43 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.297 -0.877 . . . . 0.0 109.519 179.755 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.444 ' N ' ' HD2' ' A' ' 24' ' ' ARG . . . 123.53 -22.37 6.98 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 -179.63 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 74.0 m80 -127.52 -162.27 1.15 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.294 -1.121 . . . . 0.0 109.489 179.37 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 84.8 mtt85 -111.62 128.05 55.93 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.228 -0.92 . . . . 0.0 109.461 179.818 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 97.1 m-20 -91.37 140.28 29.92 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.135 -0.978 . . . . 0.0 109.461 -179.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 21.5 t -106.08 132.85 52.13 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.272 -0.893 . . . . 0.0 109.436 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.57 ' CD1' ' NZ ' ' A' ' 44' ' ' LYS . 78.4 m-85 -120.96 142.23 49.94 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.299 -0.876 . . . . 0.0 109.444 179.634 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -112.31 146.36 38.39 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.299 -0.876 . . . . 0.0 109.536 -179.642 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 87.7 m-85 -126.49 139.98 52.81 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.176 -0.953 . . . . 0.0 109.529 179.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.686 ' HG ' ' N ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -100.44 165.18 14.87 Favored Pre-proline 0 N--CA 1.489 1.502 0 O-C-N 121.223 -0.923 . . . . 0.0 109.418 179.644 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.686 ' N ' ' HG ' ' A' ' 39' ' ' SER . 18.8 Cg_endo -58.81 -19.37 46.43 Favored 'Trans proline' 0 C--N 1.306 -1.685 0 C-N-CA 122.783 2.322 . . . . 0.0 112.258 179.705 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.483 ' H ' ' HG ' ' A' ' 39' ' ' SER . 3.0 p -89.98 -0.91 57.84 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.291 -0.88 . . . . 0.0 109.433 179.725 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 86.61 14.65 65.17 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.506 -1.438 . . . . 0.0 109.506 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -80.35 117.42 21.09 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.296 -1.12 . . . . 0.0 109.511 -179.633 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.57 ' NZ ' ' CD1' ' A' ' 36' ' ' PHE . 61.5 tttm -92.57 128.86 38.58 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.297 -0.877 . . . . 0.0 109.396 178.765 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.624 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 1.0 OUTLIER -139.71 147.25 40.66 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.222 -0.924 . . . . 0.0 109.457 -179.716 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.623 ' NE ' ' O ' ' A' ' 46' ' ' ARG . 0.6 OUTLIER -137.36 62.12 1.6 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.161 -0.962 . . . . 0.0 109.53 179.635 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -150.14 133.34 16.31 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.306 -0.871 . . . . 0.0 109.433 179.871 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.599 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 1.1 tmtp? -55.42 -46.79 99.65 Favored Pre-proline 0 N--CA 1.491 1.59 0 O-C-N 121.238 -0.913 . . . . 0.0 109.437 -179.599 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.599 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 51.8 Cg_exo -53.7 -35.28 77.56 Favored 'Trans proline' 0 C--N 1.306 -1.685 0 C-N-CA 122.813 2.342 . . . . 0.0 112.234 -179.799 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.581 ' OE1' ' NH2' ' A' ' 53' ' ' ARG . 3.6 mm100 -67.09 -36.85 82.86 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.246 -0.909 . . . . 0.0 109.554 179.821 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.475 ' CD2' ' N ' ' A' ' 51' ' ' LEU . 3.8 mm? -66.4 -53.9 30.56 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.153 -0.967 . . . . 0.0 109.457 -179.046 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.617 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -66.97 -47.7 70.77 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.331 -0.855 . . . . 0.0 109.511 -178.521 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.581 ' NH2' ' OE1' ' A' ' 50' ' ' GLN . 57.3 ttp180 -59.21 -45.06 92.11 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.278 -0.889 . . . . 0.0 109.463 -178.839 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -69.7 -54.48 13.6 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.334 -0.854 . . . . 0.0 109.468 -179.211 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.457 ' O ' ' O ' ' A' ' 56' ' ' GLY . 1.8 mm? -80.42 -0.58 37.74 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.271 -0.893 . . . . 0.0 109.487 -179.462 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.919 ' O ' ' N ' ' A' ' 58' ' ' SER . . . -51.39 -176.13 0.03 OUTLIER Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.514 -1.434 . . . . 0.0 109.514 179.641 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 43.9 -69.81 0.0 OUTLIER Glycine 0 N--CA 1.491 2.337 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.919 ' N ' ' O ' ' A' ' 56' ' ' GLY . 82.8 p -57.72 -30.89 65.91 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.29 -1.123 . . . . 0.0 109.441 -178.244 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.443 ' O ' ' O ' ' A' ' 55' ' ' LEU . 1.3 mmm -167.29 160.19 13.33 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.209 -0.932 . . . . 0.0 109.493 -179.419 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 45.2 t0 -109.59 129.08 55.61 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.201 -0.937 . . . . 0.0 109.441 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 94.4 mt -114.65 16.12 17.55 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.193 -0.942 . . . . 0.0 109.427 -179.173 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 12.0 t -58.03 -38.04 75.48 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.257 -0.902 . . . . 0.0 109.462 179.825 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 17.9 p -87.9 19.62 3.46 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.266 -0.896 . . . . 0.0 109.5 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 60.0 t80 -88.52 132.38 34.53 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.213 -0.929 . . . . 0.0 109.458 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.454 ' OD2' ' OG1' ' A' ' 68' ' ' THR . 60.1 t0 -83.43 111.51 19.1 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.356 -0.84 . . . . 0.0 109.454 -179.39 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 15.6 t80 -76.63 -39.93 50.85 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.256 -0.903 . . . . 0.0 109.517 -179.792 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.48 ' H ' ' NE ' ' A' ' 67' ' ' ARG . 0.2 OUTLIER -63.83 -42.29 97.65 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.182 -0.949 . . . . 0.0 109.575 -179.16 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.454 ' OG1' ' OD2' ' A' ' 65' ' ' ASP . 27.5 p -98.43 -12.47 21.34 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.317 -0.864 . . . . 0.0 109.591 -179.359 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.45 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 63.21 39.87 98.41 Favored Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.526 -1.43 . . . . 0.0 109.526 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.403 ' H ' ' HB3' ' A' ' 65' ' ' ASP . 68.6 mttm -140.3 157.76 45.07 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.154 -1.204 . . . . 0.0 109.453 -179.523 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 68.4 mtp -86.02 132.21 34.1 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.257 -0.902 . . . . 0.0 109.556 179.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 4.0 mm? . . . . . 0 N--CA 1.491 1.612 0 O-C-N 121.301 -0.874 . . . . 0.0 109.472 179.939 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.528 4.799 0 N-CA-C 119.396 2.519 . . . . 0.0 119.396 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.0 p -89.52 4.67 48.49 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.25 -1.147 . . . . 0.0 109.535 179.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 99.8 mmm -70.98 52.06 0.15 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.338 -0.851 . . . . 0.0 109.42 -179.775 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 66.46 15.07 10.0 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.172 -0.955 . . . . 0.0 109.508 179.623 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.6 mtt85 -163.68 112.56 1.24 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.324 -0.86 . . . . 0.0 109.411 179.534 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.407 ' HB2' ' CZ2' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -121.84 113.64 19.93 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.318 -0.863 . . . . 0.0 109.441 -179.86 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.492 ' C ' ' CD ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -102.86 123.17 46.0 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.22 -0.925 . . . . 0.0 109.462 179.849 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.407 ' CZ2' ' HB2' ' A' ' 6' ' ' LYS . 7.7 m0 -125.76 175.21 7.78 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.284 -0.885 . . . . 0.0 109.458 179.844 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 31.2 tp10 -81.15 155.12 26.37 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.271 -0.893 . . . . 0.0 109.526 179.686 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.554 ' SG ' ' N ' ' A' ' 19' ' ' ARG . 3.4 m -114.3 100.51 52.95 Favored Pre-proline 0 N--CA 1.49 1.562 0 O-C-N 121.29 -0.881 . . . . 0.0 109.395 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -53.64 -38.04 84.01 Favored 'Trans proline' 0 C--N 1.305 -1.727 0 C-N-CA 122.879 2.386 . . . . 0.0 112.255 179.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.0 -39.5 78.43 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.225 -0.922 . . . . 0.0 109.529 -179.522 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.574 ' CD2' ' N ' ' A' ' 13' ' ' LEU . 2.5 mm? -91.63 155.78 43.53 Favored Pre-proline 0 N--CA 1.489 1.499 0 O-C-N 121.2 -0.937 . . . . 0.0 109.546 179.896 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -55.59 160.27 9.62 Favored 'Trans proline' 0 C--N 1.303 -1.819 0 C-N-CA 122.905 2.403 . . . . 0.0 112.228 -179.591 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 59.3 tt0 -54.63 125.32 19.34 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.206 -0.934 . . . . 0.0 109.466 -179.166 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 125.23 -20.99 6.54 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.601 -1.4 . . . . 0.0 109.601 179.259 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 34.9 m95 -89.59 140.9 29.09 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.196 -1.179 . . . . 0.0 109.488 178.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.577 ' N ' ' OE1' ' A' ' 18' ' ' GLU . 54.5 mp0 -135.8 152.8 51.46 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.269 -0.895 . . . . 0.0 109.508 -179.09 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.554 ' N ' ' SG ' ' A' ' 10' ' ' CYS . 4.8 ptm85 -118.52 161.24 20.35 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.269 -0.894 . . . . 0.0 109.428 178.82 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 79.1 tt0 -143.05 137.43 29.22 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.208 -0.932 . . . . 0.0 109.5 -179.351 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -110.91 131.0 55.42 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.241 -0.912 . . . . 0.0 109.334 -179.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.9 t -136.1 123.27 14.5 Favored Pre-proline 0 N--CA 1.49 1.528 0 O-C-N 121.165 -0.959 . . . . 0.0 109.549 -179.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -75.76 135.51 17.8 Favored 'Trans proline' 0 C--N 1.304 -1.791 0 C-N-CA 122.816 2.344 . . . . 0.0 112.209 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.448 ' HG2' ' H ' ' A' ' 25' ' ' ARG . 35.8 ttm180 -92.41 169.78 10.29 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.237 -0.914 . . . . 0.0 109.429 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.448 ' H ' ' HG2' ' A' ' 24' ' ' ARG . 90.3 mtm-85 -126.47 125.09 41.52 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.157 -0.964 . . . . 0.0 109.544 179.568 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 14.0 t -168.63 159.06 9.75 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.265 -0.897 . . . . 0.0 109.427 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -66.09 -86.76 0.07 OUTLIER Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.55 -1.42 . . . . 0.0 109.55 -179.65 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.553 ' CD2' ' H ' ' A' ' 28' ' ' LEU . 0.1 OUTLIER -69.3 -34.13 74.23 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.262 -1.14 . . . . 0.0 109.426 -179.317 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.681 ' HG ' ' CE1' ' A' ' 32' ' ' HIS . 1.1 m -78.73 14.62 1.26 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.23 -0.919 . . . . 0.0 109.421 -179.467 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.11 148.68 30.35 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.193 -0.942 . . . . 0.0 109.379 179.849 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 90.02 -16.15 57.75 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 179.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . 0.681 ' CE1' ' HG ' ' A' ' 29' ' ' SER . 19.1 m170 -59.95 111.63 1.55 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.328 -1.101 . . . . 0.0 109.441 179.796 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 62.4 ttp180 -114.14 126.19 54.8 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.28 -0.888 . . . . 0.0 109.419 -179.642 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.505 ' OD1' ' O ' ' A' ' 34' ' ' ASP . 3.5 p30 -107.25 141.46 38.52 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.224 -0.923 . . . . 0.0 109.403 -179.827 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 35.1 t -114.89 131.91 65.68 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.143 -0.973 . . . . 0.0 109.426 -179.817 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -106.57 148.32 28.4 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.287 -0.883 . . . . 0.0 109.409 179.497 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.574 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 63.4 m-85 -116.1 147.18 41.58 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.302 -0.874 . . . . 0.0 109.439 -179.396 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -129.39 143.03 50.68 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.228 -0.92 . . . . 0.0 109.491 -179.446 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.429 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -97.88 176.57 1.98 Allowed Pre-proline 0 N--CA 1.491 1.575 0 O-C-N 121.347 -0.846 . . . . 0.0 109.428 179.784 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.429 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 48.6 Cg_exo -54.46 -28.53 54.83 Favored 'Trans proline' 0 C--N 1.305 -1.74 0 C-N-CA 122.888 2.392 . . . . 0.0 112.227 179.632 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 95.0 p -89.67 0.68 56.8 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.241 -0.912 . . . . 0.0 109.475 179.781 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 83.91 17.75 64.77 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 -179.681 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 61.0 tttp -70.5 122.58 19.95 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.25 -1.147 . . . . 0.0 109.479 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 63.7 tttm -92.39 125.83 37.22 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.222 -0.924 . . . . 0.0 109.531 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.492 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 3.3 p90 -140.32 146.99 39.2 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.225 -0.922 . . . . 0.0 109.466 -179.693 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.418 HH11 ' HD2' ' A' ' 46' ' ' ARG . 6.3 ptm85 -139.31 59.28 1.61 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.359 -0.838 . . . . 0.0 109.433 179.138 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.3 m -152.38 131.84 12.96 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.188 -0.945 . . . . 0.0 109.52 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.614 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 3.2 tmtp? -61.2 -45.39 95.54 Favored Pre-proline 0 N--CA 1.489 1.505 0 O-C-N 121.221 -0.924 . . . . 0.0 109.413 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.614 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 42.7 Cg_exo -55.69 -43.39 58.04 Favored 'Trans proline' 0 C--N 1.305 -1.747 0 C-N-CA 122.807 2.338 . . . . 0.0 112.224 179.58 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -65.02 -36.46 84.46 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.229 -0.919 . . . . 0.0 109.542 179.408 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 15.1 mt -62.11 -44.29 96.97 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.32 -0.863 . . . . 0.0 109.491 -179.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.708 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -77.2 -46.61 22.71 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.223 -0.923 . . . . 0.0 109.502 -179.865 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 14.1 tpp180 -54.15 -26.57 28.42 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.152 -0.967 . . . . 0.0 109.505 -179.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 68.1 t80 -97.59 -53.39 3.45 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.295 -0.878 . . . . 0.0 109.519 -179.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.467 ' C ' ' H ' ' A' ' 57' ' ' GLY . 3.4 tp -106.93 -4.6 18.94 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.197 -0.939 . . . . 0.0 109.497 -178.005 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.708 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -61.61 -2.38 3.32 Favored Glycine 0 N--CA 1.489 2.213 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 -179.789 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . 0.467 ' H ' ' C ' ' A' ' 55' ' ' LEU . . . -99.17 -52.18 1.27 Allowed Glycine 0 N--CA 1.491 2.318 0 N-CA-C 109.526 -1.429 . . . . 0.0 109.526 -179.842 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 9.3 m -77.86 -10.43 59.56 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.265 -1.138 . . . . 0.0 109.524 179.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 52.1 ttm -159.19 152.07 21.94 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.222 -0.924 . . . . 0.0 109.483 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.477 ' OD1' ' OG ' ' A' ' 62' ' ' SER . 59.6 t0 -91.27 110.82 22.12 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.253 -0.904 . . . . 0.0 109.476 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.544 ' CD2' ' N ' ' A' ' 61' ' ' LEU . 3.8 mm? -93.72 -1.07 55.62 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.334 -0.854 . . . . 0.0 109.445 -179.929 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.477 ' OG ' ' OD1' ' A' ' 60' ' ' ASP . 94.1 p -57.63 -37.47 73.37 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.265 -0.897 . . . . 0.0 109.55 179.609 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 48.3 p -91.75 10.15 29.59 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.196 -0.94 . . . . 0.0 109.549 -179.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.462 ' O ' ' NZ ' ' A' ' 48' ' ' LYS . 49.9 t80 -87.51 132.7 33.94 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.204 -0.935 . . . . 0.0 109.487 -179.905 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.478 ' CG ' ' OG1' ' A' ' 68' ' ' THR . 55.3 t0 -85.49 110.81 19.45 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.298 -0.876 . . . . 0.0 109.543 -179.835 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.574 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 81.7 t80 -77.2 -41.32 41.85 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.269 -0.895 . . . . 0.0 109.482 -179.402 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 16.5 tpp180 -63.19 -42.53 99.35 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.265 -0.897 . . . . 0.0 109.501 -179.177 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.478 ' OG1' ' CG ' ' A' ' 65' ' ' ASP . 25.5 p -96.22 -13.4 23.48 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.297 -0.877 . . . . 0.0 109.473 -179.529 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.415 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 62.54 41.87 99.75 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.415 -1.474 . . . . 0.0 109.415 179.731 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -134.54 147.87 50.39 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.222 -1.164 . . . . 0.0 109.43 -179.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 34.2 ttm -89.86 125.17 35.23 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.217 -0.927 . . . . 0.0 109.561 -179.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 2.3 pp . . . . . 0 N--CA 1.489 1.52 0 O-C-N 121.223 -0.923 . . . . 0.0 109.519 179.833 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.528 4.782 0 N-CA-C 119.323 2.489 . . . . 0.0 119.323 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 83.0 p -166.57 127.2 1.65 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.243 -1.151 . . . . 0.0 109.443 179.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 7.8 ptp -85.3 122.41 29.43 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.3 -0.875 . . . . 0.0 109.391 179.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 -97.89 144.0 27.9 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.295 -0.878 . . . . 0.0 109.479 179.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.38 171.7 11.74 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.208 -0.932 . . . . 0.0 109.443 179.861 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.621 ' NZ ' ' O ' ' A' ' 21' ' ' GLU . 0.3 OUTLIER -115.61 110.39 19.13 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.207 -0.933 . . . . 0.0 109.493 179.864 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 86.3 mtm180 -93.5 112.37 24.26 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.365 -0.834 . . . . 0.0 109.483 -179.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 11.9 m0 -105.26 160.16 15.32 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.267 -0.896 . . . . 0.0 109.376 179.355 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -77.2 139.4 39.88 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.179 -0.95 . . . . 0.0 109.455 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 2.4 t -106.12 102.49 40.09 Favored Pre-proline 0 N--CA 1.49 1.528 0 O-C-N 121.269 -0.894 . . . . 0.0 109.548 179.309 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -72.48 -13.26 27.6 Favored 'Trans proline' 0 C--N 1.304 -1.764 0 C-N-CA 122.838 2.359 . . . . 0.0 112.265 -178.521 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -82.65 -20.11 36.91 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.181 -0.949 . . . . 0.0 109.494 -179.682 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.567 ' CD2' ' N ' ' A' ' 13' ' ' LEU . 3.8 mm? -101.13 157.93 32.74 Favored Pre-proline 0 N--CA 1.49 1.55 0 O-C-N 121.222 -0.924 . . . . 0.0 109.465 -179.873 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -52.69 144.67 41.99 Favored 'Trans proline' 0 C--N 1.305 -1.742 0 C-N-CA 122.804 2.336 . . . . 0.0 112.188 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -47.19 123.33 5.33 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.281 -0.887 . . . . 0.0 109.445 -179.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 124.02 -21.77 6.9 Favored Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.647 -1.381 . . . . 0.0 109.647 179.67 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . 0.406 ' CZ3' ' CZ ' ' A' ' 45' ' ' PHE . 21.3 m95 -85.42 146.68 26.86 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.225 -1.162 . . . . 0.0 109.439 179.505 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -132.13 149.32 52.43 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.194 -0.941 . . . . 0.0 109.451 -179.554 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 77.7 ttt-85 -114.92 157.44 23.36 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.188 -0.945 . . . . 0.0 109.497 179.416 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -152.5 153.68 33.97 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.248 -0.908 . . . . 0.0 109.494 -179.092 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.621 ' O ' ' NZ ' ' A' ' 6' ' ' LYS . 79.2 tt0 -119.5 131.28 55.54 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.331 -0.856 . . . . 0.0 109.338 179.318 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.6 t -130.28 125.35 21.75 Favored Pre-proline 0 N--CA 1.489 1.517 0 O-C-N 121.218 -0.926 . . . . 0.0 109.6 -179.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -73.76 122.63 7.91 Favored 'Trans proline' 0 C--N 1.304 -1.81 0 C-N-CA 122.804 2.336 . . . . 0.0 112.156 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.717 ' HE ' ' H ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -77.44 157.98 30.24 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.199 -0.938 . . . . 0.0 109.473 -179.716 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.717 ' H ' ' HE ' ' A' ' 24' ' ' ARG . 17.5 ptm180 -142.79 144.63 32.66 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.208 -0.933 . . . . 0.0 109.521 -179.602 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -179.17 -67.93 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.244 -0.91 . . . . 0.0 109.438 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 177.73 -84.87 0.07 OUTLIER Glycine 0 N--CA 1.489 2.219 0 N-CA-C 109.591 -1.403 . . . . 0.0 109.591 -179.709 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 98.0 mt -62.64 -41.83 99.26 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.279 -1.13 . . . . 0.0 109.441 179.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 6.4 p -100.7 29.98 4.22 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.251 -0.906 . . . . 0.0 109.479 179.326 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -72.27 110.67 6.87 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.362 -0.836 . . . . 0.0 109.418 -179.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 123.33 -6.54 9.25 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 13.4 m170 -60.89 152.46 27.36 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.301 -1.117 . . . . 0.0 109.406 179.348 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 38.2 mmm-85 -112.27 109.07 18.52 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.254 -0.904 . . . . 0.0 109.508 -179.395 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -94.22 141.13 28.91 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.193 -0.942 . . . . 0.0 109.39 179.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 49.0 t -107.32 132.11 55.65 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.282 -0.887 . . . . 0.0 109.4 -179.152 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 -122.4 145.88 47.86 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.208 -0.933 . . . . 0.0 109.469 178.598 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.672 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 63.6 m-85 -119.02 151.52 38.07 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.311 -0.868 . . . . 0.0 109.382 -179.275 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 47.3 m-85 -123.7 139.9 53.53 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.187 -0.946 . . . . 0.0 109.518 179.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.451 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -95.37 177.28 1.85 Allowed Pre-proline 0 N--CA 1.49 1.561 0 O-C-N 121.33 -0.856 . . . . 0.0 109.539 179.178 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.451 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 48.3 Cg_exo -54.33 -29.21 56.9 Favored 'Trans proline' 0 C--N 1.304 -1.763 0 C-N-CA 122.838 2.359 . . . . 0.0 112.116 179.92 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 20.9 t -90.46 -1.55 57.9 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.251 -0.906 . . . . 0.0 109.499 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 86.46 22.51 47.12 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 75.5 tttt -75.42 127.17 32.52 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.193 -1.181 . . . . 0.0 109.453 -179.721 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.424 ' O ' ' HG3' ' A' ' 44' ' ' LYS . 21.3 ptmt -93.0 124.79 37.22 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.247 -0.908 . . . . 0.0 109.477 179.382 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.51 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 3.6 p90 -141.87 150.53 41.69 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.207 -0.933 . . . . 0.0 109.439 179.803 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.553 ' CD ' ' N ' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -135.66 67.02 1.49 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.262 -0.899 . . . . 0.0 109.472 179.708 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.3 m -157.15 116.87 3.43 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.304 -0.873 . . . . 0.0 109.403 179.551 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.584 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -53.78 -46.84 98.25 Favored Pre-proline 0 N--CA 1.489 1.52 0 O-C-N 121.256 -0.902 . . . . 0.0 109.542 -178.933 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.584 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 52.2 Cg_exo -54.35 -39.13 88.51 Favored 'Trans proline' 0 C--N 1.305 -1.717 0 C-N-CA 122.805 2.336 . . . . 0.0 112.202 179.433 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -61.54 -36.3 80.19 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.297 -0.877 . . . . 0.0 109.448 179.369 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 11.2 mp -66.46 -42.58 87.35 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.255 -0.903 . . . . 0.0 109.437 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -66.89 -50.41 62.54 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.174 -0.954 . . . . 0.0 109.471 -179.563 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.424 HH22 ' HB2' ' A' ' 49' ' ' PRO . 96.1 mtm-85 -60.18 -44.88 94.71 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.209 -0.932 . . . . 0.0 109.542 -179.378 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 67.8 t80 -65.81 -55.21 18.31 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.201 -0.937 . . . . 0.0 109.466 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 96.5 mt -61.45 -42.01 98.1 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.21 -0.931 . . . . 0.0 109.504 -179.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 93.94 -146.53 18.18 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 109.561 -1.416 . . . . 0.0 109.561 179.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -98.16 27.38 19.54 Favored Glycine 0 N--CA 1.492 2.381 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 179.761 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 13.0 m -89.42 -25.8 21.33 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.261 -1.141 . . . . 0.0 109.485 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 97.5 mtp -143.45 134.29 25.33 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.273 -0.892 . . . . 0.0 109.412 179.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -97.94 116.39 30.05 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.284 -0.885 . . . . 0.0 109.461 179.274 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 97.1 mt -95.82 2.75 53.95 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.119 -0.988 . . . . 0.0 109.469 -179.556 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 69.0 m -50.76 -39.01 51.2 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.255 -0.903 . . . . 0.0 109.506 179.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 31.4 p -94.6 39.67 1.09 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.254 -0.904 . . . . 0.0 109.52 179.229 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 85.0 t80 -125.75 125.67 43.35 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.257 -0.902 . . . . 0.0 109.437 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.603 ' O ' ' N ' ' A' ' 69' ' ' GLY . 89.3 m-20 -76.71 107.66 9.18 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.168 -0.958 . . . . 0.0 109.524 -179.609 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.672 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 54.5 t80 -74.78 -48.88 23.05 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.174 -0.953 . . . . 0.0 109.51 -179.821 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 18.3 mmm180 -54.72 -42.26 71.32 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.276 -0.89 . . . . 0.0 109.564 179.666 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 6.7 p -98.09 -14.35 20.51 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.169 -0.957 . . . . 0.0 109.462 -179.748 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.603 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 64.77 31.68 81.7 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 179.728 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -112.57 150.66 31.03 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.227 -1.16 . . . . 0.0 109.436 -179.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 11.9 tpp -93.86 123.97 37.56 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.197 -0.939 . . . . 0.0 109.484 179.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.465 ' C ' ' CD1' ' A' ' 72' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.573 0 O-C-N 121.135 -0.978 . . . . 0.0 109.458 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.529 4.853 0 N-CA-C 119.361 2.504 . . . . 0.0 119.361 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.6 p -72.26 163.78 27.38 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.233 -1.157 . . . . 0.0 109.45 179.584 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.612 ' O ' ' C ' ' A' ' 4' ' ' GLU . 14.8 ttt -77.99 91.27 4.22 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.217 -0.927 . . . . 0.0 109.374 -179.779 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.612 ' C ' ' O ' ' A' ' 3' ' ' MET . 5.3 pt-20 29.01 86.6 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.153 -0.967 . . . . 0.0 109.486 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 31.0 ptt180 -48.14 127.36 12.39 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.168 -0.957 . . . . 0.0 109.464 -179.543 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.5 mmtp -63.06 147.8 49.68 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.352 -0.843 . . . . 0.0 109.501 -179.291 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 73.6 ttp85 -149.97 138.93 21.02 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.234 -0.916 . . . . 0.0 109.472 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.57 ' CD1' ' N ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -167.33 142.2 3.9 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.22 -0.925 . . . . 0.0 109.463 -179.828 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -103.64 142.45 34.3 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.241 -0.912 . . . . 0.0 109.458 178.517 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.598 ' SG ' ' O ' ' A' ' 10' ' ' CYS . 0.8 OUTLIER -115.19 129.15 25.32 Favored Pre-proline 0 N--CA 1.49 1.568 0 O-C-N 121.311 -0.868 . . . . 0.0 109.461 -179.657 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -51.16 -24.26 14.59 Favored 'Trans proline' 0 C--N 1.305 -1.715 0 C-N-CA 122.901 2.401 . . . . 0.0 112.233 178.499 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.466 ' O ' ' SD ' ' A' ' 59' ' ' MET . . . -71.08 -16.44 62.58 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.196 -0.94 . . . . 0.0 109.496 -179.602 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.5 mp -102.01 148.95 36.08 Favored Pre-proline 0 N--CA 1.49 1.565 0 O-C-N 121.192 -0.943 . . . . 0.0 109.402 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.463 ' HG2' ' CD1' ' A' ' 17' ' ' TRP . 37.3 Cg_endo -67.5 149.0 79.9 Favored 'Trans proline' 0 C--N 1.305 -1.726 0 C-N-CA 122.904 2.403 . . . . 0.0 112.17 179.876 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.618 ' O ' ' NE2' ' A' ' 15' ' ' GLN . 1.5 pm0 -54.44 125.98 21.65 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.294 -0.878 . . . . 0.0 109.506 -179.131 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 122.38 -29.12 5.58 Favored Glycine 0 N--CA 1.491 2.337 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 179.351 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . 0.603 ' CZ2' ' OG ' ' A' ' 39' ' ' SER . 17.0 m95 -89.23 155.42 19.41 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.213 -1.169 . . . . 0.0 109.452 179.363 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -149.63 164.54 34.89 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.142 -0.974 . . . . 0.0 109.429 -178.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.602 ' NH1' ' O ' ' A' ' 69' ' ' GLY . 13.0 mtm105 -132.69 131.99 41.89 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.245 -0.909 . . . . 0.0 109.476 178.772 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -136.48 141.54 43.49 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.175 -0.953 . . . . 0.0 109.562 -178.771 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.537 ' OE2' ' CZ ' ' A' ' 33' ' ' ARG . 80.4 tt0 -102.43 147.01 27.25 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.315 -0.866 . . . . 0.0 109.358 179.022 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.5 t -149.31 127.59 5.9 Favored Pre-proline 0 N--CA 1.49 1.535 0 O-C-N 121.184 -0.948 . . . . 0.0 109.65 -178.603 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -77.33 140.07 19.16 Favored 'Trans proline' 0 C--N 1.306 -1.707 0 C-N-CA 122.851 2.367 . . . . 0.0 112.167 178.629 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.573 ' NE ' ' OD1' ' A' ' 34' ' ' ASP . 99.2 mtt180 -68.84 153.56 43.57 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.186 -0.947 . . . . 0.0 109.534 179.526 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 89.6 mtm180 -129.45 -28.09 2.34 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.243 -0.911 . . . . 0.0 109.525 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 44.1 t -144.1 112.45 6.44 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.314 -0.866 . . . . 0.0 109.545 -179.731 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 171.83 170.23 35.56 Favored Glycine 0 N--CA 1.491 2.3 0 N-CA-C 109.619 -1.392 . . . . 0.0 109.619 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 11.0 mp -62.58 -41.53 99.01 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.199 -1.177 . . . . 0.0 109.502 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.484 ' O ' ' C ' ' A' ' 30' ' ' ALA . 6.1 m -93.37 14.13 19.38 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.343 -0.848 . . . . 0.0 109.377 -179.784 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.484 ' C ' ' O ' ' A' ' 29' ' ' SER . . . -40.11 133.75 1.67 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.254 -0.904 . . . . 0.0 109.465 179.734 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 122.71 -34.85 3.62 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.499 -1.44 . . . . 0.0 109.499 -179.735 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -80.5 174.15 11.9 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.221 -1.164 . . . . 0.0 109.554 179.586 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.537 ' CZ ' ' OE2' ' A' ' 21' ' ' GLU . 83.7 mtp180 -120.25 136.72 54.56 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.256 -0.903 . . . . 0.0 109.415 -179.721 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.573 ' OD1' ' NE ' ' A' ' 24' ' ' ARG . 4.6 m-20 -122.74 143.5 49.78 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.239 -0.913 . . . . 0.0 109.419 -179.709 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 65.5 t -105.9 136.1 41.55 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 O-C-N 121.244 -0.91 . . . . 0.0 109.442 179.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -122.27 147.08 46.66 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.358 -0.838 . . . . 0.0 109.51 179.857 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.453 ' CB ' ' CE2' ' A' ' 45' ' ' PHE . 8.5 m-85 -112.71 139.32 48.42 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.251 -0.906 . . . . 0.0 109.455 -179.878 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 74.7 m-85 -114.33 128.44 56.35 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.221 -0.924 . . . . 0.0 109.575 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.603 ' OG ' ' CZ2' ' A' ' 17' ' ' TRP . 0.1 OUTLIER -97.61 177.28 1.69 Allowed Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.279 -0.888 . . . . 0.0 109.447 179.251 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.444 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 52.8 Cg_exo -53.76 -30.39 56.57 Favored 'Trans proline' 0 C--N 1.306 -1.677 0 C-N-CA 122.904 2.402 . . . . 0.0 112.24 179.402 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 96.4 p -87.52 4.97 41.42 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.317 -0.864 . . . . 0.0 109.461 179.56 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 74.9 12.86 82.94 Favored Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 179.755 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 5.4 ttmt -73.32 131.27 41.72 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.24 -1.153 . . . . 0.0 109.452 -179.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 16.9 pttp -94.7 130.05 41.36 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.247 -0.908 . . . . 0.0 109.447 179.195 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.668 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 0.7 OUTLIER -139.53 146.3 39.74 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.271 -0.893 . . . . 0.0 109.399 -179.918 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 46.0 ptt85 -139.88 53.07 1.68 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.367 -0.833 . . . . 0.0 109.506 -179.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.4 p -150.93 134.99 16.73 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.281 -0.887 . . . . 0.0 109.464 179.573 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.607 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 0.9 OUTLIER -58.42 -46.13 99.64 Favored Pre-proline 0 N--CA 1.49 1.563 0 O-C-N 121.216 -0.927 . . . . 0.0 109.461 179.887 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.607 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 52.2 Cg_exo -53.16 -43.23 58.92 Favored 'Trans proline' 0 C--N 1.305 -1.717 0 C-N-CA 122.836 2.357 . . . . 0.0 112.189 -179.655 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -68.19 -33.94 75.36 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.248 -0.907 . . . . 0.0 109.522 179.096 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.432 ' CD1' ' C ' ' A' ' 51' ' ' LEU . 0.3 OUTLIER -59.37 -49.68 76.88 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.246 -0.909 . . . . 0.0 109.488 179.65 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -71.77 -37.6 70.45 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.183 -0.948 . . . . 0.0 109.55 -179.566 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 42.3 ttm180 -56.22 -51.08 69.4 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.247 -0.908 . . . . 0.0 109.558 -179.336 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . 0.471 ' C ' ' H ' ' A' ' 56' ' ' GLY . 18.4 t80 -68.51 -50.03 55.17 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.368 -0.833 . . . . 0.0 109.503 -179.708 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.486 ' O ' ' OG ' ' A' ' 58' ' ' SER . 4.2 mm? -64.23 1.2 0.78 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.144 -0.972 . . . . 0.0 109.444 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.548 ' O ' ' C ' ' A' ' 57' ' ' GLY . . . 51.91 64.0 4.31 Favored Glycine 0 N--CA 1.492 2.384 0 N-CA-C 109.46 -1.456 . . . . 0.0 109.46 179.794 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . 0.548 ' C ' ' O ' ' A' ' 56' ' ' GLY . . . 33.82 36.0 0.05 OUTLIER Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.556 -1.417 . . . . 0.0 109.556 -179.515 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.53 ' N ' ' O ' ' A' ' 56' ' ' GLY . 74.2 m -85.24 -0.58 55.1 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.21 -1.171 . . . . 0.0 109.486 179.746 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.466 ' SD ' ' O ' ' A' ' 12' ' ' ALA . 40.6 ttp -157.34 149.69 22.86 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.351 -0.843 . . . . 0.0 109.497 -179.869 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 91.1 m-20 -86.34 106.35 17.33 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.292 -0.88 . . . . 0.0 109.405 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.56 ' CD2' ' N ' ' A' ' 61' ' ' LEU . 3.7 mm? -89.61 -4.89 57.62 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.222 -0.924 . . . . 0.0 109.462 -179.933 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 37.9 m -58.49 -33.89 70.3 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.297 -0.877 . . . . 0.0 109.532 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 17.9 p -96.45 9.22 42.01 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.178 -0.951 . . . . 0.0 109.48 -179.82 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 89.7 t80 -90.24 135.12 33.87 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.225 -0.922 . . . . 0.0 109.419 179.807 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.515 ' O ' ' N ' ' A' ' 69' ' ' GLY . 9.8 m-20 -85.67 111.29 19.95 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.248 -0.908 . . . . 0.0 109.582 179.818 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 77.4 t80 -75.16 -47.64 27.45 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.211 -0.931 . . . . 0.0 109.392 -179.286 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.417 ' HA ' ' HE ' ' A' ' 67' ' ' ARG . 0.3 OUTLIER -56.4 -43.84 79.7 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.251 -0.906 . . . . 0.0 109.474 -179.351 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 30.0 p -94.51 -15.38 24.21 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.165 -0.959 . . . . 0.0 109.515 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.602 ' O ' ' NH1' ' A' ' 19' ' ' ARG . . . 63.69 35.68 92.35 Favored Glycine 0 N--CA 1.49 2.239 0 N-CA-C 109.568 -1.413 . . . . 0.0 109.568 179.797 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 54.8 mtpt -125.61 151.35 46.6 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.329 -1.101 . . . . 0.0 109.529 -179.543 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 10.8 tpp -93.54 121.78 35.3 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.257 -0.902 . . . . 0.0 109.405 179.812 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 56.4 tp . . . . . 0 N--CA 1.49 1.559 0 O-C-N 121.179 -0.951 . . . . 0.0 109.416 179.876 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 33.8 ptt180 . . . . . 0 N--CA 1.49 1.561 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 12.6 mttp -85.26 169.89 13.35 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.25 -0.907 . . . . 0.0 109.539 179.209 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.547 ' NH1' ' OE2' ' A' ' 20' ' ' GLU . 61.8 ttt85 -155.87 95.04 1.6 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.207 -0.933 . . . . 0.0 109.441 -178.942 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 7.7 m0 -111.24 139.41 46.64 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.247 -0.908 . . . . 0.0 109.475 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -83.43 149.67 26.53 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.276 -0.89 . . . . 0.0 109.467 179.605 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 34.3 m -114.75 100.46 53.39 Favored Pre-proline 0 N--CA 1.491 1.587 0 O-C-N 121.203 -0.935 . . . . 0.0 109.492 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -55.56 -27.21 58.75 Favored 'Trans proline' 0 C--N 1.305 -1.748 0 C-N-CA 122.877 2.385 . . . . 0.0 112.272 178.3 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.41 -34.48 74.01 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.257 -0.902 . . . . 0.0 109.474 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.413 ' N ' HD23 ' A' ' 13' ' ' LEU . 9.4 mt -90.15 157.46 45.37 Favored Pre-proline 0 N--CA 1.489 1.524 0 O-C-N 121.18 -0.95 . . . . 0.0 109.376 -179.812 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_exo -54.8 145.26 62.08 Favored 'Trans proline' 0 C--N 1.305 -1.723 0 C-N-CA 122.848 2.365 . . . . 0.0 112.185 179.664 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 94.4 mm-40 -49.57 127.85 16.38 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.323 -0.861 . . . . 0.0 109.463 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 123.88 -18.35 7.55 Favored Glycine 0 N--CA 1.49 2.24 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' TRP . . . . . 0.405 ' CD1' ' N ' ' A' ' 17' ' ' TRP . 21.1 m95 -93.0 150.74 20.33 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.259 -1.142 . . . . 0.0 109.468 179.14 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.509 ' N ' ' OE1' ' A' ' 18' ' ' GLU . 59.4 mp0 -144.42 160.91 40.28 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.227 -0.92 . . . . 0.0 109.463 -179.474 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.533 ' CZ ' HG11 ' A' ' 35' ' ' VAL . 33.6 ttt180 -121.2 156.88 31.45 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.221 -0.924 . . . . 0.0 109.42 179.286 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.547 ' OE2' ' NH1' ' A' ' 7' ' ' ARG . 95.9 mt-10 -147.23 142.59 27.39 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.221 -0.924 . . . . 0.0 109.524 -179.662 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 80.2 tt0 -115.18 133.85 55.67 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.277 -0.889 . . . . 0.0 109.456 179.58 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.6 t -129.09 123.29 21.67 Favored Pre-proline 0 N--CA 1.491 1.589 0 O-C-N 121.272 -0.893 . . . . 0.0 109.538 -178.847 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -77.04 129.86 10.85 Favored 'Trans proline' 0 C--N 1.306 -1.701 0 C-N-CA 122.868 2.379 . . . . 0.0 112.145 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 23.3 mmm180 . . . . . 0 N--CA 1.491 1.585 0 O-C-N 121.185 -0.947 . . . . 0.0 109.424 179.973 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 . . . . . 0 N--CA 1.491 1.575 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 84.7 mtm-85 -115.64 127.61 55.32 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.246 -0.909 . . . . 0.0 109.556 -179.727 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.451 ' OD1' ' N ' ' A' ' 35' ' ' VAL . 62.8 t0 -106.12 142.55 35.63 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.229 -0.919 . . . . 0.0 109.417 -179.902 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.533 HG11 ' CZ ' ' A' ' 19' ' ' ARG . 46.9 t -111.03 129.4 66.36 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.246 -0.909 . . . . 0.0 109.413 -179.592 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -116.69 145.37 43.49 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.255 -0.903 . . . . 0.0 109.514 179.118 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.627 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 60.2 m-85 -115.05 149.8 36.91 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.273 -0.892 . . . . 0.0 109.472 179.638 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 94.9 m-85 -127.76 140.39 52.09 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.246 -0.909 . . . . 0.0 109.518 179.397 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.47 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -97.91 178.35 1.36 Allowed Pre-proline 0 N--CA 1.489 1.509 0 O-C-N 121.242 -0.911 . . . . 0.0 109.504 179.452 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.47 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 35.6 Cg_exo -56.6 -29.31 78.66 Favored 'Trans proline' 0 C--N 1.305 -1.727 0 C-N-CA 122.826 2.351 . . . . 0.0 112.206 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 91.4 p -87.39 -0.92 57.5 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.164 -0.96 . . . . 0.0 109.485 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 83.53 22.2 56.71 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -74.8 126.06 30.12 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.262 -1.14 . . . . 0.0 109.454 179.655 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -94.33 121.55 35.97 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.275 -0.89 . . . . 0.0 109.542 179.447 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.636 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 1.2 p90 -141.36 149.83 41.65 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.214 -0.929 . . . . 0.0 109.506 -179.874 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.93 68.62 1.42 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.256 -0.903 . . . . 0.0 109.464 179.247 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 44.9 m -151.06 130.71 13.09 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.279 -0.888 . . . . 0.0 109.466 179.617 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.736 ' N ' ' HD2' ' A' ' 49' ' ' PRO . 20.3 tttt -60.73 -53.92 59.61 Favored Pre-proline 0 N--CA 1.49 1.54 0 O-C-N 121.288 -0.882 . . . . 0.0 109.457 -179.517 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.736 ' HD2' ' N ' ' A' ' 48' ' ' LYS . 10.9 Cg_endo -52.99 -38.53 80.02 Favored 'Trans proline' 0 C--N 1.304 -1.766 0 C-N-CA 122.853 2.369 . . . . 0.0 112.203 -179.521 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 92.9 mt-30 -64.66 -36.95 85.91 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.205 -0.934 . . . . 0.0 109.521 178.926 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 4.1 mt -64.75 -44.53 89.8 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.284 -0.885 . . . . 0.0 109.429 179.712 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.696 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -73.79 -45.57 50.78 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.213 -0.929 . . . . 0.0 109.485 -179.219 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -60.88 -44.52 96.97 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.265 -0.897 . . . . 0.0 109.489 -179.792 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 29.0 t80 -66.8 -54.17 25.38 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.312 -0.868 . . . . 0.0 109.492 -179.482 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 94.6 mt -91.84 10.58 28.02 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.224 -0.923 . . . . 0.0 109.479 -179.436 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLY . . . . . 0.696 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -49.61 -71.08 0.66 Allowed Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 -179.63 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -54.07 -44.06 73.25 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 109.568 -1.413 . . . . 0.0 109.568 -179.427 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 95.8 p -59.36 -29.66 67.84 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.231 -1.158 . . . . 0.0 109.463 -179.666 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.661 ' SD ' HD21 ' A' ' 61' ' ' LEU . 0.0 OUTLIER 179.5 173.38 0.86 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.229 -0.919 . . . . 0.0 109.479 -179.856 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 90.6 m-20 -102.24 123.48 46.15 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.287 -0.883 . . . . 0.0 109.477 179.758 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.661 HD21 ' SD ' ' A' ' 59' ' ' MET . 98.6 mt -116.88 13.69 15.03 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.236 -0.915 . . . . 0.0 109.483 -179.586 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 92.9 p -56.11 -33.9 65.55 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.27 -0.894 . . . . 0.0 109.475 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 21.5 p -92.88 19.77 7.32 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.218 -0.926 . . . . 0.0 109.519 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -88.57 135.6 33.41 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.204 -0.935 . . . . 0.0 109.445 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.518 ' O ' ' N ' ' A' ' 69' ' ' GLY . 51.8 t0 -87.38 111.56 21.22 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.192 -0.943 . . . . 0.0 109.481 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.627 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 74.6 t80 -75.91 -41.68 51.15 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.227 -0.92 . . . . 0.0 109.527 -179.323 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.422 ' HD2' ' N ' ' A' ' 67' ' ' ARG . 3.2 mpt_? -62.12 -39.51 92.78 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.199 -0.938 . . . . 0.0 109.494 -179.046 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' THR . . . . . 0.458 ' OG1' ' CG ' ' A' ' 65' ' ' ASP . 44.0 p -103.05 -13.41 16.85 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.309 -0.869 . . . . 0.0 109.471 -178.447 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' GLY . . . . . 0.518 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 62.79 42.37 99.69 Favored Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.476 ' H ' ' HB3' ' A' ' 65' ' ' ASP . 68.6 mttm -132.71 154.5 50.12 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.227 -1.161 . . . . 0.0 109.488 -179.775 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 57.0 ttm -91.61 125.13 36.23 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.291 -0.881 . . . . 0.0 109.514 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 8.6 tp . . . . . 0 N--CA 1.489 1.525 0 O-C-N 121.259 -0.901 . . . . 0.0 109.479 179.85 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 85.0 mtp180 . . . . . 0 N--CA 1.489 1.507 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.436 ' O ' ' HA ' ' A' ' 20' ' ' GLU . 0.5 OUTLIER -111.14 106.18 15.13 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.264 -0.897 . . . . 0.0 109.53 179.917 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 56.0 ttp180 -102.13 118.12 36.22 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.181 -0.95 . . . . 0.0 109.34 -179.466 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.559 ' CD1' ' N ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -124.99 144.56 50.32 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.221 -0.924 . . . . 0.0 109.429 179.603 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -57.43 141.27 47.97 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.207 -0.933 . . . . 0.0 109.443 -179.745 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.5 ' SG ' ' C ' ' A' ' 17' ' ' TRP . 0.8 OUTLIER -96.64 123.03 55.52 Favored Pre-proline 0 N--CA 1.491 1.588 0 O-C-N 121.254 -0.904 . . . . 0.0 109.51 179.72 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -73.75 -32.87 7.02 Favored 'Trans proline' 0 C--N 1.304 -1.771 0 C-N-CA 122.88 2.387 . . . . 0.0 112.249 -178.77 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.0 -38.02 85.26 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.337 -0.852 . . . . 0.0 109.516 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.578 ' CD1' ' N ' ' A' ' 13' ' ' LEU . 5.1 mp -84.01 156.59 63.8 Favored Pre-proline 0 N--CA 1.49 1.566 0 O-C-N 121.277 -0.889 . . . . 0.0 109.52 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -49.72 155.75 3.63 Favored 'Trans proline' 0 C--N 1.306 -1.699 0 C-N-CA 122.774 2.316 . . . . 0.0 112.284 179.6 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -56.29 123.73 15.61 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.19 -0.944 . . . . 0.0 109.468 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 123.26 -33.99 3.82 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 179.445 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' TRP . . . . . 0.5 ' C ' ' SG ' ' A' ' 10' ' ' CYS . 49.8 m95 -71.31 149.59 45.97 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.308 -1.113 . . . . 0.0 109.481 179.222 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 68.3 mt-10 -145.32 157.98 43.93 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.345 -0.847 . . . . 0.0 109.54 -178.644 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.426 ' NH1' ' O ' ' A' ' 68' ' ' THR . 21.1 ptt180 -141.59 145.62 35.28 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.3 -0.875 . . . . 0.0 109.432 179.046 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.436 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 19.2 pt-20 -130.39 143.3 50.68 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.226 -0.921 . . . . 0.0 109.584 -179.385 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -98.59 136.99 37.89 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.267 -0.896 . . . . 0.0 109.471 178.417 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 30.7 t -143.13 100.92 5.3 Favored Pre-proline 0 N--CA 1.49 1.575 0 O-C-N 121.23 -0.919 . . . . 0.0 109.529 -179.172 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_exo -56.69 136.51 76.58 Favored 'Trans proline' 0 C--N 1.305 -1.726 0 C-N-CA 122.872 2.382 . . . . 0.0 112.185 177.388 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 23.0 ptt180 . . . . . 0 N--CA 1.491 1.598 0 O-C-N 121.239 -0.913 . . . . 0.0 109.491 179.825 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 28.9 m170 . . . . . 0 N--CA 1.49 1.531 0 N-CA-C 109.468 -0.568 . . . . 0.0 109.468 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 50.5 ptt85 -118.35 137.53 53.03 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.351 -0.843 . . . . 0.0 109.465 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.409 ' OD1' ' N ' ' A' ' 35' ' ' VAL . 64.0 t0 -104.16 133.92 48.27 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.26 -0.9 . . . . 0.0 109.438 -179.495 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.409 ' N ' ' OD1' ' A' ' 34' ' ' ASP . 57.7 t -109.68 132.91 56.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 O-C-N 121.26 -0.9 . . . . 0.0 109.442 179.379 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -111.72 141.81 44.87 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.233 -0.917 . . . . 0.0 109.388 -179.176 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.541 ' CE1' ' CZ ' ' A' ' 66' ' ' PHE . 44.1 m-85 -114.81 143.25 45.38 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.25 -0.907 . . . . 0.0 109.475 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 87.8 m-85 -122.91 133.34 54.41 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.182 -0.949 . . . . 0.0 109.513 -179.324 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.472 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.4 OUTLIER -98.59 178.59 1.26 Allowed Pre-proline 0 N--CA 1.491 1.576 0 O-C-N 121.262 -0.899 . . . . 0.0 109.486 179.58 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.472 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 48.7 Cg_exo -54.6 -29.92 62.99 Favored 'Trans proline' 0 C--N 1.305 -1.752 0 C-N-CA 122.853 2.369 . . . . 0.0 112.206 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 96.4 p -85.89 7.82 22.65 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.272 -0.892 . . . . 0.0 109.485 179.74 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 72.71 8.59 72.76 Favored Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 -179.76 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 3.8 tmmt? -67.49 128.99 38.49 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.298 -1.119 . . . . 0.0 109.492 -179.759 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 51.9 pttt -99.14 130.34 45.45 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.262 -0.899 . . . . 0.0 109.451 179.02 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.491 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 9.8 p90 -141.69 149.19 40.24 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.306 -0.872 . . . . 0.0 109.479 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 25.7 ptt-85 -130.84 50.69 2.2 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.176 -0.952 . . . . 0.0 109.486 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -159.27 143.87 15.45 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.226 -0.921 . . . . 0.0 109.478 -179.888 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.633 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 10.6 tttt -60.14 -44.67 96.99 Favored Pre-proline 0 N--CA 1.489 1.501 0 O-C-N 121.205 -0.934 . . . . 0.0 109.515 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.633 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 47.3 Cg_exo -55.99 -38.69 94.33 Favored 'Trans proline' 0 C--N 1.305 -1.741 0 C-N-CA 122.855 2.37 . . . . 0.0 112.192 179.706 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 94.9 mm-40 -67.57 -37.97 83.4 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.259 -0.901 . . . . 0.0 109.482 179.535 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.46 ' CD1' ' CZ3' ' A' ' 17' ' ' TRP . 57.8 tp -61.04 -45.58 94.19 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.307 -0.871 . . . . 0.0 109.509 179.747 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.517 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -68.59 -40.37 80.51 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.241 -0.912 . . . . 0.0 109.392 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 77.7 ttt-85 -53.5 -44.65 69.25 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.328 -0.857 . . . . 0.0 109.478 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 50.5 t80 -66.31 -49.2 67.86 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.242 -0.911 . . . . 0.0 109.423 179.365 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.583 ' O ' ' N ' ' A' ' 57' ' ' GLY . 98.6 mt -80.75 4.87 17.5 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.25 -0.906 . . . . 0.0 109.454 179.753 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLY . . . . . 0.517 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . 60.11 -74.6 0.01 OUTLIER Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.561 -1.416 . . . . 0.0 109.561 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' GLY . . . . . 0.583 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . 177.28 37.66 0.06 OUTLIER Glycine 0 N--CA 1.49 2.241 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 -179.712 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 87.1 p -93.34 8.32 40.91 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.23 -1.159 . . . . 0.0 109.45 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 99.7 mtp -145.87 139.83 26.59 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.23 -0.918 . . . . 0.0 109.5 -179.75 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.404 ' OD1' ' N ' ' A' ' 60' ' ' ASP . 38.4 p-10 -80.53 96.02 6.67 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.103 -0.998 . . . . 0.0 109.494 179.572 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 90.1 mt -95.41 -1.83 50.19 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.286 -0.884 . . . . 0.0 109.48 -179.309 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 35.8 t -53.96 -29.83 44.37 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.182 -0.949 . . . . 0.0 109.505 179.741 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 69.4 p -106.91 18.49 21.75 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.302 -0.874 . . . . 0.0 109.527 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.437 ' O ' ' CE ' ' A' ' 48' ' ' LYS . 14.8 t80 -88.22 124.73 34.14 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.215 -0.928 . . . . 0.0 109.51 -179.746 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.415 ' O ' ' N ' ' A' ' 69' ' ' GLY . 7.8 m-20 -79.92 113.57 18.18 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.302 -0.874 . . . . 0.0 109.451 -179.535 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.541 ' CZ ' ' CE1' ' A' ' 37' ' ' TYR . 58.5 t80 -79.24 -42.21 26.45 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.293 -0.879 . . . . 0.0 109.442 -179.791 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 83.7 mmt-85 -62.86 -40.17 96.67 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.199 -0.938 . . . . 0.0 109.453 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' THR . . . . . 0.426 ' O ' ' NH1' ' A' ' 19' ' ' ARG . 27.6 p -97.78 -13.62 21.26 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.335 -0.853 . . . . 0.0 109.472 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' GLY . . . . . 0.415 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 61.62 40.41 98.71 Favored Glycine 0 N--CA 1.489 2.204 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 -179.844 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -128.67 149.7 50.56 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.172 -1.193 . . . . 0.0 109.437 -179.627 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 36.6 ttm -94.12 112.86 24.71 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.267 -0.896 . . . . 0.0 109.397 179.702 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.437 HD22 ' HA ' ' A' ' 72' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.533 0 O-C-N 121.287 -0.883 . . . . 0.0 109.41 -179.88 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.4 tpt180 . . . . . 0 N--CA 1.491 1.578 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 31.1 mttt -79.4 169.69 17.7 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.291 -0.88 . . . . 0.0 109.462 -179.64 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.574 ' O ' ' CD1' ' A' ' 8' ' ' TRP . 79.0 mtp85 -143.66 135.12 26.08 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.324 -0.86 . . . . 0.0 109.455 -178.701 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.574 ' CD1' ' O ' ' A' ' 7' ' ' ARG . 6.3 m0 -157.85 129.09 6.63 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.207 -0.933 . . . . 0.0 109.438 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 45.8 tt0 -86.9 121.58 29.58 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.149 -0.97 . . . . 0.0 109.556 178.949 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.467 ' CA ' HH12 ' A' ' 19' ' ' ARG . 0.0 OUTLIER -79.61 123.85 83.97 Favored Pre-proline 0 N--CA 1.49 1.532 0 O-C-N 121.316 -0.865 . . . . 0.0 109.479 -179.444 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -71.8 -13.53 29.46 Favored 'Trans proline' 0 C--N 1.305 -1.721 0 C-N-CA 122.797 2.331 . . . . 0.0 112.235 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.563 ' HB3' ' CE1' ' A' ' 64' ' ' PHE . . . -82.64 -14.72 54.22 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.279 -0.888 . . . . 0.0 109.531 179.76 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.618 HD21 HD11 ' A' ' 51' ' ' LEU . 5.8 mp -100.38 156.07 35.66 Favored Pre-proline 0 N--CA 1.49 1.571 0 O-C-N 121.161 -0.962 . . . . 0.0 109.428 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' PRO . . . . . 0.577 ' CG ' HD11 ' A' ' 55' ' ' LEU . 31.5 Cg_exo -57.1 142.09 94.27 Favored 'Trans proline' 0 C--N 1.305 -1.741 0 C-N-CA 122.911 2.407 . . . . 0.0 112.202 178.791 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -47.77 128.82 13.6 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.323 -0.86 . . . . 0.0 109.411 179.741 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 117.83 -17.79 11.82 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 -179.617 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' TRP . . . . . 0.403 ' NE1' ' HD3' ' A' ' 40' ' ' PRO . 24.3 m95 -92.09 151.77 20.26 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.365 -1.079 . . . . 0.0 109.458 179.866 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -151.05 164.8 35.59 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.252 -0.905 . . . . 0.0 109.502 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.467 HH12 ' CA ' ' A' ' 10' ' ' CYS . 35.9 ptt-85 -142.7 149.13 38.41 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.29 -0.881 . . . . 0.0 109.509 179.331 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -124.51 162.94 22.93 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.26 -0.9 . . . . 0.0 109.509 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -117.54 135.66 53.79 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.302 -0.874 . . . . 0.0 109.388 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.4 t -131.32 115.2 16.15 Favored Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.261 -0.899 . . . . 0.0 109.546 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -76.58 142.02 22.81 Favored 'Trans proline' 0 C--N 1.304 -1.786 0 C-N-CA 122.91 2.407 . . . . 0.0 112.13 -179.262 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 23.0 mmt180 . . . . . 0 N--CA 1.49 1.546 0 O-C-N 121.247 -0.908 . . . . 0.0 109.579 179.734 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 31.6 m170 . . . . . 0 N--CA 1.489 1.522 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -108.78 111.94 23.96 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.316 -0.865 . . . . 0.0 109.495 -179.601 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 87.3 m-20 -84.69 139.3 32.11 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.285 -0.884 . . . . 0.0 109.433 179.086 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 42.6 t -113.82 128.74 70.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.298 -0.876 . . . . 0.0 109.453 -179.857 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.417 ' CE2' ' HD3' ' A' ' 46' ' ' ARG . 67.2 m-85 -105.62 142.81 34.71 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.324 -0.86 . . . . 0.0 109.437 179.608 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.552 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 68.4 m-85 -109.66 144.5 37.93 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.285 -0.884 . . . . 0.0 109.44 -179.406 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 -128.22 141.81 51.35 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.246 -0.909 . . . . 0.0 109.543 -179.485 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.461 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.4 OUTLIER -99.95 177.04 1.66 Allowed Pre-proline 0 N--CA 1.489 1.52 0 O-C-N 121.254 -0.904 . . . . 0.0 109.506 179.485 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.461 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 47.1 Cg_exo -55.45 -35.43 92.1 Favored 'Trans proline' 0 C--N 1.306 -1.704 0 C-N-CA 122.77 2.313 . . . . 0.0 112.31 -178.976 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 68.1 m -80.35 -4.4 53.31 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.206 -0.934 . . . . 0.0 109.482 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 89.42 16.0 57.78 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 179.722 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -66.75 122.15 17.02 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.262 -1.14 . . . . 0.0 109.471 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.403 ' CE ' ' CD2' ' A' ' 36' ' ' PHE . 87.4 tttt -93.99 123.03 37.09 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.267 -0.896 . . . . 0.0 109.472 179.306 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.609 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 1.6 p90 -140.92 148.37 40.32 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.335 -0.853 . . . . 0.0 109.418 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.417 ' HD3' ' CE2' ' A' ' 36' ' ' PHE . 65.7 ttp85 -134.07 65.46 1.57 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.184 -0.947 . . . . 0.0 109.508 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.9 m -150.12 130.28 13.6 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.231 -0.918 . . . . 0.0 109.452 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.719 ' N ' ' HD2' ' A' ' 49' ' ' PRO . 24.1 tttt -62.8 -54.08 50.43 Favored Pre-proline 0 N--CA 1.49 1.53 0 O-C-N 121.279 -0.888 . . . . 0.0 109.489 -179.857 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.719 ' HD2' ' N ' ' A' ' 48' ' ' LYS . 18.9 Cg_endo -57.65 -38.66 92.65 Favored 'Trans proline' 0 C--N 1.306 -1.692 0 C-N-CA 122.792 2.328 . . . . 0.0 112.198 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -65.39 -39.73 92.57 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.28 -0.887 . . . . 0.0 109.5 179.833 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.779 ' O ' HD23 ' A' ' 51' ' ' LEU . 5.1 tt -69.29 -41.15 77.2 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.26 -0.9 . . . . 0.0 109.536 179.797 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.576 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -62.62 -43.02 99.86 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.185 -0.947 . . . . 0.0 109.472 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.493 HH12 ' HB2' ' A' ' 49' ' ' PRO . 92.6 mtm-85 -59.45 -42.51 92.14 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.306 -0.871 . . . . 0.0 109.479 179.492 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -59.78 -50.23 74.63 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.396 -0.815 . . . . 0.0 109.508 179.127 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.577 HD11 ' CG ' ' A' ' 14' ' ' PRO . 3.6 mm? -85.78 -0.13 54.43 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.186 -0.946 . . . . 0.0 109.491 178.383 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLY . . . . . 0.576 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -61.87 97.6 0.16 Allowed Glycine 0 N--CA 1.492 2.367 0 N-CA-C 109.506 -1.438 . . . . 0.0 109.506 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 132.26 -63.98 0.62 Allowed Glycine 0 N--CA 1.489 2.226 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 76.2 p -69.88 -24.75 63.46 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.182 -1.187 . . . . 0.0 109.574 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.569 ' HB3' HD12 ' A' ' 55' ' ' LEU . 55.1 ttm -159.3 149.5 19.13 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.229 -0.92 . . . . 0.0 109.475 -179.717 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.569 ' C ' HD12 ' A' ' 61' ' ' LEU . 49.8 t0 -95.16 117.04 29.54 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.235 -0.916 . . . . 0.0 109.45 179.63 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.569 HD12 ' C ' ' A' ' 60' ' ' ASP . 10.7 mp -113.44 10.23 18.24 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.336 -0.853 . . . . 0.0 109.433 -179.392 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 50.3 m -52.44 -37.28 56.54 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.234 -0.916 . . . . 0.0 109.463 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 17.9 p -92.62 18.83 8.11 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.188 -0.945 . . . . 0.0 109.485 179.549 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.563 ' CE1' ' HB3' ' A' ' 12' ' ' ALA . 70.0 t80 -90.99 132.58 35.9 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.19 -0.944 . . . . 0.0 109.387 179.628 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.503 ' O ' ' N ' ' A' ' 69' ' ' GLY . 60.7 t0 -82.63 112.65 19.71 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.205 -0.935 . . . . 0.0 109.563 179.911 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.552 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 73.7 t80 -75.17 -44.3 47.43 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.207 -0.933 . . . . 0.0 109.417 -179.23 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 13.7 tpt180 -58.06 -44.5 87.49 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.263 -0.898 . . . . 0.0 109.423 -179.118 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' THR . . . . . 0.452 ' OG1' ' CG ' ' A' ' 65' ' ' ASP . 49.7 p -97.13 -12.94 22.49 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.292 -0.88 . . . . 0.0 109.468 -179.288 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' GLY . . . . . 0.503 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 61.65 40.86 99.32 Favored Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -130.77 156.24 45.3 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.314 -1.109 . . . . 0.0 109.453 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.483 ' HB2' ' HB2' ' A' ' 12' ' ' ALA . 5.4 ttm -94.98 120.43 35.18 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.267 -0.895 . . . . 0.0 109.492 179.852 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.448 HD22 ' HA ' ' A' ' 72' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.573 0 O-C-N 121.269 -0.894 . . . . 0.0 109.424 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.419 ' HD2' ' N ' ' A' ' 5' ' ' ARG . 11.7 mpt_? . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.58 96.84 7.63 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.263 -0.898 . . . . 0.0 109.529 -179.6 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.444 ' O ' ' CG ' ' A' ' 8' ' ' TRP . 99.3 mtt180 -71.81 167.59 19.65 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.254 -0.904 . . . . 0.0 109.5 179.604 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.444 ' CG ' ' O ' ' A' ' 7' ' ' ARG . 0.8 OUTLIER -166.21 144.66 5.66 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.17 -0.956 . . . . 0.0 109.514 -179.716 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.465 ' N ' ' OE1' ' A' ' 9' ' ' GLU . 58.7 mp0 -92.56 137.05 32.7 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.25 -0.906 . . . . 0.0 109.454 179.73 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.539 ' SG ' ' O ' ' A' ' 69' ' ' GLY . 0.5 OUTLIER -115.11 101.44 54.49 Favored Pre-proline 0 N--CA 1.49 1.529 0 O-C-N 121.301 -0.874 . . . . 0.0 109.567 -179.831 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -51.3 -37.79 60.83 Favored 'Trans proline' 0 C--N 1.306 -1.683 0 C-N-CA 122.872 2.381 . . . . 0.0 112.208 179.743 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.94 -24.3 64.25 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.213 -0.929 . . . . 0.0 109.511 179.387 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 7.2 mp -87.41 157.13 53.43 Favored Pre-proline 0 N--CA 1.49 1.554 0 O-C-N 121.324 -0.86 . . . . 0.0 109.542 179.491 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' PRO . . . . . 0.461 ' HG2' ' CD1' ' A' ' 17' ' ' TRP . 18.0 Cg_endo -59.8 140.76 94.79 Favored 'Trans proline' 0 C--N 1.305 -1.742 0 C-N-CA 122.802 2.334 . . . . 0.0 112.172 -179.694 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -53.18 121.49 7.61 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.279 -0.888 . . . . 0.0 109.524 -179.175 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 122.6 -27.48 5.98 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 179.276 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' TRP . . . . . 0.461 ' CD1' ' HG2' ' A' ' 14' ' ' PRO . 11.5 m95 -83.69 154.45 23.65 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.343 -1.093 . . . . 0.0 109.553 179.728 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -143.68 157.94 44.03 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.325 -0.86 . . . . 0.0 109.455 -179.436 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.57 ' NH1' ' O ' ' A' ' 69' ' ' GLY . 33.8 ptt180 -124.42 163.56 21.53 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.244 -0.91 . . . . 0.0 109.485 179.777 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -141.8 140.92 33.13 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.284 -0.885 . . . . 0.0 109.571 -179.172 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 28.5 tp10 -101.89 122.36 43.86 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.317 -0.865 . . . . 0.0 109.438 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.419 HG13 ' HE ' ' A' ' 5' ' ' ARG . 2.5 t -118.25 98.47 51.41 Favored Pre-proline 0 N--CA 1.49 1.529 0 O-C-N 121.17 -0.956 . . . . 0.0 109.639 -179.778 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -58.58 128.04 26.8 Favored 'Trans proline' 0 C--N 1.305 -1.712 0 C-N-CA 122.851 2.367 . . . . 0.0 112.184 179.387 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.421 ' NE ' ' HB2' ' A' ' 34' ' ' ASP . 99.5 mtt180 . . . . . 0 N--CA 1.49 1.529 0 O-C-N 121.148 -0.97 . . . . 0.0 109.462 178.844 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 73.6 m80 . . . . . 0 N--CA 1.491 1.577 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 94.9 mtt-85 -110.59 121.51 45.5 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.26 -0.9 . . . . 0.0 109.518 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.421 ' HB2' ' NE ' ' A' ' 24' ' ' ARG . 58.6 t0 -84.38 136.68 33.78 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.318 -0.864 . . . . 0.0 109.474 179.32 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 25.0 t -111.06 128.16 67.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.267 -0.896 . . . . 0.0 109.502 -179.128 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 52.9 m-85 -117.44 147.15 42.97 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.245 -0.909 . . . . 0.0 109.499 179.098 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 -117.8 148.96 41.58 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.195 -0.941 . . . . 0.0 109.363 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.425 ' CD1' ' N ' ' A' ' 38' ' ' TYR . 12.9 m-85 -133.21 144.59 49.9 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.216 -0.928 . . . . 0.0 109.579 -178.759 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.6 p -103.38 159.44 29.28 Favored Pre-proline 0 N--CA 1.491 1.584 0 O-C-N 121.24 -0.913 . . . . 0.0 109.474 179.051 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -54.01 -16.36 9.01 Favored 'Trans proline' 0 C--N 1.304 -1.779 0 C-N-CA 122.788 2.325 . . . . 0.0 112.271 178.286 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 4.5 m -86.15 -2.16 58.09 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.242 -0.911 . . . . 0.0 109.526 179.081 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 84.83 5.83 85.94 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 41.6 tttp -75.67 119.61 19.93 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.255 -1.144 . . . . 0.0 109.38 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -93.53 121.98 35.49 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.221 -0.924 . . . . 0.0 109.487 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.456 ' CZ ' ' CZ3' ' A' ' 17' ' ' TRP . 2.7 p90 -141.0 149.69 42.09 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.252 -0.905 . . . . 0.0 109.437 178.865 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.696 ' O ' ' C ' ' A' ' 47' ' ' SER . 70.8 ttp85 -124.58 -72.54 0.67 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.321 -0.862 . . . . 0.0 109.463 179.815 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.696 ' C ' ' O ' ' A' ' 46' ' ' ARG . 0.7 OUTLIER -21.26 130.41 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.321 -0.862 . . . . 0.0 109.503 179.664 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.656 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 4.8 tttm -65.74 -42.79 57.01 Favored Pre-proline 0 N--CA 1.491 1.584 0 O-C-N 121.171 -0.956 . . . . 0.0 109.498 179.866 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.656 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 49.8 Cg_exo -54.77 -49.62 16.12 Favored 'Trans proline' 0 C--N 1.306 -1.704 0 C-N-CA 122.831 2.354 . . . . 0.0 112.253 -179.521 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.422 ' HG2' ' N ' ' A' ' 51' ' ' LEU . 0.6 OUTLIER -68.01 -33.78 75.25 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.282 -0.886 . . . . 0.0 109.546 179.765 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.422 ' N ' ' HG2' ' A' ' 50' ' ' GLN . 6.9 tt -62.55 -43.88 97.73 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.281 -0.887 . . . . 0.0 109.46 179.68 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -69.84 -40.21 75.95 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.238 -0.914 . . . . 0.0 109.503 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 70.8 ttp85 -58.44 -44.15 89.04 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.291 -0.881 . . . . 0.0 109.535 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 42.8 t80 -59.54 -50.68 72.98 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.228 -0.92 . . . . 0.0 109.545 179.51 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.406 HD21 ' CZ2' ' A' ' 17' ' ' TRP . 80.1 mt -58.12 -43.15 87.05 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.158 -0.964 . . . . 0.0 109.47 179.278 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLY . . . . . 0.412 ' O ' ' C ' ' A' ' 57' ' ' GLY . . . 65.35 83.07 0.1 OUTLIER Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 179.086 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' GLY . . . . . 0.412 ' C ' ' O ' ' A' ' 56' ' ' GLY . . . 44.08 72.95 0.28 Allowed Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.515 -1.434 . . . . 0.0 109.515 179.058 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 6.9 m -119.5 -26.7 5.71 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.256 -1.144 . . . . 0.0 109.509 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.587 ' SD ' HD21 ' A' ' 61' ' ' LEU . 0.2 OUTLIER -169.34 160.0 9.12 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.29 -0.881 . . . . 0.0 109.506 179.94 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 50.5 t0 -80.6 92.36 5.94 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.345 -0.847 . . . . 0.0 109.5 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.587 HD21 ' SD ' ' A' ' 59' ' ' MET . 96.0 mt -100.98 -0.56 36.35 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.279 -0.888 . . . . 0.0 109.402 -179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 5.0 t -54.4 -30.84 53.49 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.268 -0.895 . . . . 0.0 109.522 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 76.0 p -92.27 11.49 25.63 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.225 -0.922 . . . . 0.0 109.437 179.723 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.41 ' CZ ' ' C ' ' A' ' 69' ' ' GLY . 74.3 t80 -86.89 131.78 34.01 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.27 -0.894 . . . . 0.0 109.519 -179.74 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.518 ' O ' ' N ' ' A' ' 69' ' ' GLY . 55.8 t0 -82.94 114.82 21.48 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.266 -0.896 . . . . 0.0 109.478 -179.629 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 24.2 t80 -75.18 -47.42 28.45 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.179 -0.95 . . . . 0.0 109.523 -179.505 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 7.7 mmt85 -55.22 -42.33 73.23 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.133 -0.98 . . . . 0.0 109.478 -179.002 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' THR . . . . . 0.404 ' OG1' ' CG ' ' A' ' 65' ' ' ASP . 33.2 p -98.69 -13.97 20.02 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.223 -0.923 . . . . 0.0 109.53 -179.455 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' GLY . . . . . 0.57 ' O ' ' NH1' ' A' ' 19' ' ' ARG . . . 61.07 40.85 99.1 Favored Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 179.777 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -134.8 153.77 51.89 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.297 -1.12 . . . . 0.0 109.492 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 12.8 ttm -87.41 126.28 34.78 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.271 -0.893 . . . . 0.0 109.479 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 72' ' ' LEU . 97.0 mt . . . . . 0 N--CA 1.489 1.506 0 O-C-N 121.239 -0.913 . . . . 0.0 109.501 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 61.0 ttp180 . . . . . 0 N--CA 1.49 1.534 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.4 mptt -120.9 113.96 20.87 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.25 -0.906 . . . . 0.0 109.447 179.766 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.448 ' CZ ' ' OE2' ' A' ' 18' ' ' GLU . 14.8 ttp180 -96.36 118.05 32.11 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.285 -0.884 . . . . 0.0 109.468 -179.548 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 5.1 m0 -106.43 156.26 18.72 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.3 -0.875 . . . . 0.0 109.502 179.464 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 84.9 tt0 -72.45 148.73 44.86 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.3 -0.875 . . . . 0.0 109.51 -179.734 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.592 ' SG ' ' CZ ' ' A' ' 19' ' ' ARG . 74.8 m -106.69 104.83 52.86 Favored Pre-proline 0 N--CA 1.49 1.559 0 O-C-N 121.244 -0.91 . . . . 0.0 109.473 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.405 ' HD2' HH22 ' A' ' 19' ' ' ARG . 55.5 Cg_endo -76.56 -21.19 13.24 Favored 'Trans proline' 0 C--N 1.306 -1.671 0 C-N-CA 122.78 2.32 . . . . 0.0 112.241 -179.565 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -84.24 -34.91 23.76 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.225 -0.922 . . . . 0.0 109.498 179.498 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.618 ' CD1' ' N ' ' A' ' 13' ' ' LEU . 4.6 mp -82.6 156.48 68.13 Favored Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.215 -0.928 . . . . 0.0 109.435 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -51.64 140.26 46.24 Favored 'Trans proline' 0 C--N 1.305 -1.722 0 C-N-CA 122.827 2.352 . . . . 0.0 112.192 179.352 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.471 ' CD ' ' H ' ' A' ' 15' ' ' GLN . 1.3 mp0 -45.85 122.85 4.01 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.27 -0.894 . . . . 0.0 109.448 -179.836 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 123.25 -18.86 7.77 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.59 -1.404 . . . . 0.0 109.59 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' TRP . . . . . 0.708 ' CZ2' HD21 ' A' ' 55' ' ' LEU . 26.5 m95 -92.65 151.18 20.24 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.176 -1.191 . . . . 0.0 109.499 179.405 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.448 ' OE2' ' CZ ' ' A' ' 7' ' ' ARG . 71.3 mt-10 -148.89 162.51 39.71 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.181 -0.949 . . . . 0.0 109.487 -179.399 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.592 ' CZ ' ' SG ' ' A' ' 10' ' ' CYS . 10.9 ptp85 -140.04 146.11 38.57 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.298 -0.876 . . . . 0.0 109.492 179.58 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -139.13 146.71 40.98 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.203 -0.935 . . . . 0.0 109.471 -178.901 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -103.1 140.14 37.7 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.311 -0.868 . . . . 0.0 109.47 178.919 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.0 t -141.6 123.48 9.12 Favored Pre-proline 0 N--CA 1.491 1.598 0 O-C-N 121.227 -0.921 . . . . 0.0 109.584 -179.609 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -75.4 135.41 18.33 Favored 'Trans proline' 0 C--N 1.304 -1.767 0 C-N-CA 122.863 2.375 . . . . 0.0 112.153 178.99 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 18.6 ttm180 . . . . . 0 N--CA 1.489 1.519 0 O-C-N 121.176 -0.953 . . . . 0.0 109.527 -179.927 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 73.9 m80 . . . . . 0 N--CA 1.488 1.443 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 17.2 ptp180 -117.7 134.59 54.74 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.214 -0.929 . . . . 0.0 109.486 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -105.2 141.88 35.95 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.281 -0.887 . . . . 0.0 109.45 -179.057 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 43.6 t -109.76 135.71 47.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.236 -0.915 . . . . 0.0 109.414 179.615 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 55.3 m-85 -121.96 144.18 49.03 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.17 -0.956 . . . . 0.0 109.49 -179.576 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.582 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 54.6 m-85 -115.68 147.89 40.34 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.284 -0.885 . . . . 0.0 109.475 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 36.4 m-85 -127.25 141.04 51.82 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.297 -0.877 . . . . 0.0 109.456 -179.524 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.458 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.4 OUTLIER -98.86 177.64 1.52 Allowed Pre-proline 0 N--CA 1.49 1.553 0 O-C-N 121.375 -0.828 . . . . 0.0 109.397 179.448 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.458 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 53.0 Cg_exo -54.36 -34.67 81.57 Favored 'Trans proline' 0 C--N 1.305 -1.726 0 C-N-CA 122.861 2.374 . . . . 0.0 112.322 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 46.6 t -85.8 1.16 50.8 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.298 -0.876 . . . . 0.0 109.468 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 85.41 15.86 65.5 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 81.9 tttt -66.52 121.54 15.57 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.189 -1.183 . . . . 0.0 109.514 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 62.4 tttm -92.77 124.85 37.07 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.206 -0.933 . . . . 0.0 109.506 179.612 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.553 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 2.3 p90 -139.88 146.12 38.89 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.264 -0.898 . . . . 0.0 109.455 -179.721 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 14.9 ptm180 -136.64 59.57 1.69 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.233 -0.917 . . . . 0.0 109.493 179.296 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.7 p -153.35 137.65 16.6 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.324 -0.86 . . . . 0.0 109.476 179.563 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.607 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 0.9 OUTLIER -66.52 -46.23 58.34 Favored Pre-proline 0 N--CA 1.489 1.499 0 O-C-N 121.314 -0.866 . . . . 0.0 109.503 -179.298 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.607 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 44.3 Cg_exo -55.83 -48.88 17.71 Favored 'Trans proline' 0 C--N 1.305 -1.738 0 C-N-CA 122.855 2.37 . . . . 0.0 112.261 -178.817 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -65.76 -37.42 86.29 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.229 -0.919 . . . . 0.0 109.502 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 44.5 tp -65.75 -47.57 74.78 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.286 -0.883 . . . . 0.0 109.553 -179.31 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.648 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -67.01 -45.55 77.23 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.324 -0.86 . . . . 0.0 109.51 -179.58 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 62.6 ttp180 -60.68 -45.54 93.75 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.173 -0.954 . . . . 0.0 109.514 -179.637 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 25.5 t80 -63.08 -52.57 62.2 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.301 -0.874 . . . . 0.0 109.479 -179.066 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.708 HD21 ' CZ2' ' A' ' 17' ' ' TRP . 98.0 mt -88.7 3.98 48.87 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.21 -0.931 . . . . 0.0 109.447 -179.922 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLY . . . . . 0.648 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -61.89 -39.66 97.81 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.49 -1.444 . . . . 0.0 109.49 -179.621 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -83.23 2.35 87.19 Favored Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.51 -1.436 . . . . 0.0 109.51 -179.562 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 79.3 p -119.13 -23.31 6.86 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.326 -1.103 . . . . 0.0 109.457 -179.643 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 8.3 ttm -176.49 168.99 2.68 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.29 -0.881 . . . . 0.0 109.459 -179.616 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.517 ' C ' HD22 ' A' ' 61' ' ' LEU . 93.5 m-20 -96.39 114.57 26.26 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.226 -0.921 . . . . 0.0 109.5 179.382 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.567 HD22 ' N ' ' A' ' 61' ' ' LEU . 3.6 mm? -98.31 4.69 48.68 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.231 -0.918 . . . . 0.0 109.49 -179.404 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 77.5 p -58.03 -38.26 75.9 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.252 -0.905 . . . . 0.0 109.46 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 19.6 p -87.56 6.21 35.5 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.269 -0.894 . . . . 0.0 109.463 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.416 ' CZ ' ' HA2' ' A' ' 69' ' ' GLY . 55.6 t80 -91.88 122.88 34.82 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.22 -0.925 . . . . 0.0 109.448 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.451 ' O ' ' N ' ' A' ' 69' ' ' GLY . 97.5 m-20 -75.35 114.38 13.82 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.25 -0.906 . . . . 0.0 109.493 179.805 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.582 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 81.9 t80 -77.76 -41.03 38.98 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.227 -0.921 . . . . 0.0 109.497 -179.378 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -61.56 -45.12 95.5 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.198 -0.939 . . . . 0.0 109.459 -179.801 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 46.0 p -95.06 -15.53 23.37 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.229 -0.919 . . . . 0.0 109.499 -179.505 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' GLY . . . . . 0.451 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 63.92 44.64 95.75 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.57 -1.412 . . . . 0.0 109.57 -179.683 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 64.8 mttp -142.22 158.27 43.92 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.224 -1.163 . . . . 0.0 109.444 -179.338 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 1.2 mmt -79.69 136.81 36.88 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.232 -0.917 . . . . 0.0 109.435 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.43 HD12 ' HA ' ' A' ' 72' ' ' LEU . 48.9 tp . . . . . 0 N--CA 1.489 1.496 0 O-C-N 121.177 -0.952 . . . . 0.0 109.499 -179.712 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 95.3 mtt-85 . . . . . 0 N--CA 1.49 1.564 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 73.6 mttt -72.98 153.7 40.83 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.288 -0.883 . . . . 0.0 109.445 179.844 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.584 ' O ' ' CD1' ' A' ' 8' ' ' TRP . 51.4 ptt85 -149.37 140.88 23.36 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.181 -0.949 . . . . 0.0 109.506 -179.309 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.584 ' CD1' ' O ' ' A' ' 7' ' ' ARG . 7.0 m0 -147.95 129.16 14.67 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.264 -0.897 . . . . 0.0 109.513 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -99.63 127.36 45.73 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.306 -0.871 . . . . 0.0 109.458 179.523 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.475 ' HB3' ' HE ' ' A' ' 19' ' ' ARG . 4.7 t -103.47 134.79 19.56 Favored Pre-proline 0 N--CA 1.491 1.619 0 O-C-N 121.277 -0.89 . . . . 0.0 109.414 -179.629 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -69.54 -14.07 36.22 Favored 'Trans proline' 0 C--N 1.306 -1.696 0 C-N-CA 122.861 2.374 . . . . 0.0 112.194 -179.677 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.458 ' C ' HD22 ' A' ' 13' ' ' LEU . . . -69.39 -34.68 74.88 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.174 -0.954 . . . . 0.0 109.462 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.661 HD22 ' N ' ' A' ' 13' ' ' LEU . 2.6 mm? -91.02 150.47 41.84 Favored Pre-proline 0 N--CA 1.489 1.523 0 O-C-N 121.18 -0.95 . . . . 0.0 109.437 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' PRO . . . . . 0.402 ' HG2' ' CD1' ' A' ' 17' ' ' TRP . 28.3 Cg_endo -63.94 156.98 55.2 Favored 'Trans proline' 0 C--N 1.305 -1.725 0 C-N-CA 122.748 2.298 . . . . 0.0 112.219 -179.852 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 55.7 tt0 -53.29 128.02 26.72 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.227 -0.921 . . . . 0.0 109.451 -179.734 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 124.82 -23.64 6.21 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.589 -1.404 . . . . 0.0 109.589 179.782 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' TRP . . . . . 0.448 ' CH2' ' CD2' ' A' ' 55' ' ' LEU . 49.9 m95 -87.64 143.66 27.07 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.294 -1.121 . . . . 0.0 109.406 179.708 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -143.55 156.7 44.68 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.27 -0.894 . . . . 0.0 109.515 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.532 HH21 HD23 ' A' ' 13' ' ' LEU . 53.0 mtt-85 -129.38 129.44 44.75 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.292 -0.88 . . . . 0.0 109.447 179.038 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -134.04 140.43 46.66 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.273 -0.892 . . . . 0.0 109.515 -179.342 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -104.57 149.05 25.84 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.246 -0.909 . . . . 0.0 109.428 178.595 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 4.7 t -145.84 124.76 6.61 Favored Pre-proline 0 N--CA 1.491 1.625 0 O-C-N 121.209 -0.932 . . . . 0.0 109.598 -179.43 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -75.32 136.47 19.8 Favored 'Trans proline' 0 C--N 1.304 -1.784 0 C-N-CA 122.849 2.366 . . . . 0.0 112.133 179.211 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 6.4 tpt180 . . . . . 0 N--CA 1.491 1.575 0 O-C-N 121.248 -0.907 . . . . 0.0 109.496 179.767 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 80.4 m80 . . . . . 0 N--CA 1.492 1.627 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 88.0 mtm-85 -118.94 136.68 53.95 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.175 -0.953 . . . . 0.0 109.492 179.64 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 93.4 m-20 -116.61 141.31 48.36 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.278 -0.889 . . . . 0.0 109.444 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.6 t -105.19 132.79 51.16 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.26 -0.9 . . . . 0.0 109.435 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -120.76 143.3 48.88 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.223 -0.923 . . . . 0.0 109.51 179.621 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 50.6 m-85 -118.63 146.64 44.5 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.209 -0.932 . . . . 0.0 109.437 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -127.71 138.36 52.77 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.241 -0.912 . . . . 0.0 109.552 -179.572 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.498 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.4 OUTLIER -99.85 179.32 1.06 Allowed Pre-proline 0 N--CA 1.49 1.545 0 O-C-N 121.194 -0.941 . . . . 0.0 109.504 179.147 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.498 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 40.2 Cg_exo -56.43 -32.59 89.54 Favored 'Trans proline' 0 C--N 1.305 -1.76 0 C-N-CA 122.81 2.34 . . . . 0.0 112.289 -179.628 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 7.4 m -87.08 5.13 39.16 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.369 -0.832 . . . . 0.0 109.594 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 81.43 10.07 85.03 Favored Glycine 0 N--CA 1.49 2.234 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 64.9 tttp -62.89 119.43 9.37 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.238 -1.154 . . . . 0.0 109.492 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.97 123.33 39.52 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.217 -0.927 . . . . 0.0 109.429 179.045 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 41.8 p90 -141.02 147.05 38.05 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.239 -0.913 . . . . 0.0 109.493 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 44.7 ptt85 -130.6 56.05 1.79 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.253 -0.904 . . . . 0.0 109.51 179.499 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -159.33 146.77 17.19 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.193 -0.942 . . . . 0.0 109.522 -179.84 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.655 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 0.5 OUTLIER -68.87 -42.87 25.38 Favored Pre-proline 0 N--CA 1.49 1.562 0 O-C-N 121.207 -0.933 . . . . 0.0 109.504 -179.581 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.655 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 51.0 Cg_exo -55.01 -44.63 47.81 Favored 'Trans proline' 0 C--N 1.306 -1.686 0 C-N-CA 122.761 2.307 . . . . 0.0 112.231 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 18.2 mm100 -71.32 -37.0 71.79 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.229 -0.919 . . . . 0.0 109.445 179.141 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.722 ' O ' HD23 ' A' ' 51' ' ' LEU . 3.8 tt -63.44 -47.36 82.21 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.263 -0.898 . . . . 0.0 109.502 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -66.15 -41.91 89.74 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.182 -0.949 . . . . 0.0 109.497 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 77.7 ttt-85 -56.45 -45.39 80.86 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.223 -0.923 . . . . 0.0 109.511 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -66.24 -50.0 65.27 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.325 -0.86 . . . . 0.0 109.455 179.284 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.448 ' CD2' ' CH2' ' A' ' 17' ' ' TRP . 4.2 mm? -70.9 -3.32 18.62 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.199 -0.938 . . . . 0.0 109.415 179.704 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLY . . . . . 0.711 ' O ' ' N ' ' A' ' 58' ' ' SER . . . -50.87 161.68 1.28 Allowed Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.534 -1.426 . . . . 0.0 109.534 179.771 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 59.38 -61.04 0.01 OUTLIER Glycine 0 N--CA 1.489 2.226 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 -179.529 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.711 ' N ' ' O ' ' A' ' 56' ' ' GLY . 80.7 p -60.88 -28.96 69.27 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.273 -1.133 . . . . 0.0 109.463 -178.761 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.429 ' CB ' ' O ' ' A' ' 58' ' ' SER . 2.8 mtp 169.45 126.88 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.219 -0.926 . . . . 0.0 109.452 -179.479 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.794 ' O ' HD12 ' A' ' 61' ' ' LEU . 62.0 t0 -70.62 151.74 44.66 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.313 -0.867 . . . . 0.0 109.424 179.312 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.794 HD12 ' O ' ' A' ' 60' ' ' ASP . 3.7 mp -133.19 24.87 4.2 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.273 -0.892 . . . . 0.0 109.494 -179.04 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 58.0 m -52.61 -32.68 42.85 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.148 -0.97 . . . . 0.0 109.484 -179.584 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' THR . . . . . 0.509 ' O ' ' SD ' ' A' ' 71' ' ' MET . 19.8 p -94.71 35.14 1.26 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.227 -0.92 . . . . 0.0 109.481 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 93.1 t80 -99.05 129.06 45.3 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.259 -0.901 . . . . 0.0 109.455 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 91.7 m-20 -81.9 114.29 20.41 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.253 -0.904 . . . . 0.0 109.375 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -76.45 -41.13 48.47 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.305 -0.872 . . . . 0.0 109.476 -179.549 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 23.1 mmm180 -63.24 -36.34 83.35 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.312 -0.868 . . . . 0.0 109.444 -178.685 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 19.5 p -95.53 -16.04 22.45 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.299 -0.875 . . . . 0.0 109.476 -179.414 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 64.64 36.48 93.19 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.571 -1.412 . . . . 0.0 109.571 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.8 mtmp? -145.87 162.52 37.54 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.355 -1.085 . . . . 0.0 109.439 -179.573 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.509 ' SD ' ' O ' ' A' ' 63' ' ' THR . 9.6 tpp -80.84 128.33 33.54 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.235 -0.916 . . . . 0.0 109.534 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.537 HD23 ' C ' ' A' ' 72' ' ' LEU . 3.5 tt . . . . . 0 N--CA 1.491 1.605 0 O-C-N 121.336 -0.852 . . . . 0.0 109.472 -179.763 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 84.5 mtp180 . . . . . 0 N--CA 1.491 1.594 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.405 ' O ' ' HA ' ' A' ' 20' ' ' GLU . 26.3 mmtp -109.49 101.0 9.99 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.234 -0.916 . . . . 0.0 109.495 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 41.1 ttm180 -98.35 118.69 35.56 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.225 -0.922 . . . . 0.0 109.392 -179.712 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.555 ' CD1' ' N ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -132.53 152.03 51.71 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.239 -0.913 . . . . 0.0 109.503 179.284 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 79.3 tt0 -90.91 141.78 28.46 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.301 -0.874 . . . . 0.0 109.473 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -108.25 159.49 30.48 Favored Pre-proline 0 N--CA 1.49 1.533 0 O-C-N 121.336 -0.853 . . . . 0.0 109.454 179.841 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -65.05 -20.62 63.72 Favored 'Trans proline' 0 C--N 1.304 -1.764 0 C-N-CA 122.855 2.37 . . . . 0.0 112.237 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.566 ' HB3' ' CE1' ' A' ' 64' ' ' PHE . . . -93.29 -4.92 50.88 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.165 -0.959 . . . . 0.0 109.473 179.723 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.507 HD23 ' CA ' ' A' ' 18' ' ' GLU . 8.7 mp -98.95 113.41 64.54 Favored Pre-proline 0 N--CA 1.491 1.601 0 O-C-N 121.184 -0.948 . . . . 0.0 109.46 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' PRO . . . . . 0.731 ' HG2' HD11 ' A' ' 55' ' ' LEU . 49.1 Cg_exo -50.75 155.51 5.5 Favored 'Trans proline' 0 C--N 1.306 -1.707 0 C-N-CA 122.756 2.304 . . . . 0.0 112.261 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -49.93 106.8 0.13 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.305 -0.872 . . . . 0.0 109.523 179.842 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 125.89 -25.23 5.59 Favored Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.621 -1.392 . . . . 0.0 109.621 179.171 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' TRP . . . . . 0.436 ' CE2' ' HD3' ' A' ' 40' ' ' PRO . 47.6 m95 -92.86 139.7 30.27 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.302 -1.116 . . . . 0.0 109.467 178.385 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.507 ' CA ' HD23 ' A' ' 13' ' ' LEU . 96.3 mt-10 -151.73 166.19 32.07 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.211 -0.93 . . . . 0.0 109.501 -178.665 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.511 ' NH1' ' OH ' ' A' ' 37' ' ' TYR . 12.1 ptm180 -140.92 145.86 36.64 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.27 -0.894 . . . . 0.0 109.384 178.887 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.405 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 12.2 pt-20 -132.92 145.98 51.39 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.239 -0.913 . . . . 0.0 109.462 -179.117 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 79.7 tt0 -100.01 136.67 39.55 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.271 -0.893 . . . . 0.0 109.452 178.684 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.5 t -135.4 133.71 20.67 Favored Pre-proline 0 N--CA 1.49 1.566 0 O-C-N 121.158 -0.964 . . . . 0.0 109.584 -178.84 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -50.11 150.86 9.75 Favored 'Trans proline' 0 C--N 1.304 -1.779 0 C-N-CA 122.821 2.347 . . . . 0.0 112.099 178.296 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.639 0 O-C-N 121.201 -0.937 . . . . 0.0 109.44 -179.648 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 56.8 m80 . . . . . 0 N--CA 1.491 1.592 0 CA-C-O 121.341 0.591 . . . . 0.0 109.493 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -116.8 134.77 54.38 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.14 -0.975 . . . . 0.0 109.492 179.556 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.597 ' OD2' ' CE2' ' A' ' 36' ' ' PHE . 9.2 t70 -103.12 140.73 36.94 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.202 -0.936 . . . . 0.0 109.481 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.592 ' O ' ' CD ' ' A' ' 46' ' ' ARG . 97.6 t -119.67 132.12 70.3 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.251 -0.905 . . . . 0.0 109.481 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.597 ' CE2' ' OD2' ' A' ' 34' ' ' ASP . 94.5 m-85 -116.2 150.89 36.76 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.221 -0.925 . . . . 0.0 109.542 -179.674 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.596 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 23.2 m-85 -112.69 147.15 37.39 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.257 -0.902 . . . . 0.0 109.463 179.737 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -126.39 139.44 53.27 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.214 -0.929 . . . . 0.0 109.552 -179.502 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -102.23 174.57 2.78 Favored Pre-proline 0 N--CA 1.489 1.51 0 O-C-N 121.251 -0.906 . . . . 0.0 109.419 179.33 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.436 ' HD3' ' CE2' ' A' ' 17' ' ' TRP . 52.8 Cg_exo -52.79 -35.95 71.59 Favored 'Trans proline' 0 C--N 1.306 -1.699 0 C-N-CA 122.85 2.367 . . . . 0.0 112.225 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 4.2 m -82.48 -1.01 49.02 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.342 -0.848 . . . . 0.0 109.476 -179.639 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 87.15 11.93 68.82 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -70.04 116.14 10.06 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.259 -1.142 . . . . 0.0 109.494 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 20.0 pttp -94.92 132.59 39.58 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.13 -0.981 . . . . 0.0 109.5 178.881 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.443 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 8.5 p90 -141.68 151.8 43.32 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.324 -0.86 . . . . 0.0 109.49 -179.776 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.592 ' CD ' ' O ' ' A' ' 35' ' ' VAL . 24.1 tpt85 -125.26 63.39 1.17 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.175 -0.953 . . . . 0.0 109.494 179.29 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.0 t -150.84 125.66 9.74 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.24 -0.913 . . . . 0.0 109.42 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.716 ' N ' ' HD2' ' A' ' 49' ' ' PRO . 20.1 tttt -65.21 -53.47 40.04 Favored Pre-proline 0 N--CA 1.489 1.48 0 O-C-N 121.233 -0.917 . . . . 0.0 109.506 -179.598 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.716 ' HD2' ' N ' ' A' ' 48' ' ' LYS . 14.5 Cg_endo -56.56 -38.69 94.95 Favored 'Trans proline' 0 C--N 1.304 -1.765 0 C-N-CA 122.877 2.385 . . . . 0.0 112.148 179.19 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -65.5 -35.22 80.23 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.344 -0.848 . . . . 0.0 109.432 179.152 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.807 ' O ' HD23 ' A' ' 51' ' ' LEU . 4.4 tt -68.54 -42.54 78.28 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.277 -0.89 . . . . 0.0 109.491 179.647 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.591 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -62.55 -41.28 98.8 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.268 -0.895 . . . . 0.0 109.463 -179.813 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 71.7 ttp85 -59.5 -48.66 80.79 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.175 -0.953 . . . . 0.0 109.457 179.871 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 6.2 t80 -63.79 -49.08 74.33 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.268 -0.895 . . . . 0.0 109.524 179.431 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.731 HD11 ' HG2' ' A' ' 14' ' ' PRO . 3.3 mm? -81.34 -0.72 42.42 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.161 -0.962 . . . . 0.0 109.451 179.672 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLY . . . . . 0.591 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -62.07 -35.15 91.05 Favored Glycine 0 N--CA 1.489 2.218 0 N-CA-C 109.604 -1.399 . . . . 0.0 109.604 -179.584 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -88.64 -3.12 78.02 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.459 -1.456 . . . . 0.0 109.459 -179.32 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -112.34 -30.7 7.08 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.308 -1.113 . . . . 0.0 109.494 -179.574 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.437 ' O ' ' O ' ' A' ' 55' ' ' LEU . 31.2 ttp -174.58 167.25 3.86 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.286 -0.884 . . . . 0.0 109.471 -179.771 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.544 ' C ' HD12 ' A' ' 61' ' ' LEU . 93.7 m-20 -92.52 113.36 25.61 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.196 -0.94 . . . . 0.0 109.518 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.544 HD12 ' C ' ' A' ' 60' ' ' ASP . 11.1 mp -111.61 9.54 21.11 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.246 -0.909 . . . . 0.0 109.505 -179.803 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 88.5 p -55.78 -34.8 65.59 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.286 -0.884 . . . . 0.0 109.541 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 10.4 p -91.83 24.86 2.98 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.281 -0.887 . . . . 0.0 109.445 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.566 ' CE1' ' HB3' ' A' ' 12' ' ' ALA . 79.9 t80 -91.41 126.18 36.41 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.103 -0.998 . . . . 0.0 109.438 -179.915 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.552 ' O ' ' N ' ' A' ' 69' ' ' GLY . 96.5 m-20 -75.84 111.77 11.54 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.211 -0.93 . . . . 0.0 109.513 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.596 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 66.1 t80 -74.29 -45.01 50.36 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.236 -0.915 . . . . 0.0 109.49 -179.385 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 24.6 mmm180 -63.88 -37.9 89.11 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.2 -0.938 . . . . 0.0 109.471 -178.99 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' THR . . . . . 0.402 ' OG1' ' CB ' ' A' ' 65' ' ' ASP . 5.6 p -98.9 -15.26 19.24 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.297 -0.877 . . . . 0.0 109.538 -179.376 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' GLY . . . . . 0.552 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 62.3 39.11 97.3 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.634 -1.386 . . . . 0.0 109.634 -179.842 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.456 ' H ' ' HB2' ' A' ' 65' ' ' ASP . 71.7 mmtt -133.42 151.59 51.82 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.216 -1.167 . . . . 0.0 109.413 -179.407 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 6.6 ttm -96.01 124.44 40.02 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.201 -0.937 . . . . 0.0 109.381 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 58.0 tp . . . . . 0 N--CA 1.491 1.614 0 O-C-N 121.274 -0.891 . . . . 0.0 109.428 -179.709 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 89.7 mtm180 . . . . . 0 N--CA 1.49 1.567 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.434 ' H ' ' HD3' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -72.06 154.86 40.87 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.326 -0.859 . . . . 0.0 109.49 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 62.7 ttp180 -153.3 144.62 23.14 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.229 -0.92 . . . . 0.0 109.388 -179.495 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.627 ' CD1' ' N ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -166.1 139.48 4.18 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.15 -0.969 . . . . 0.0 109.536 -179.331 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -105.8 117.68 34.65 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.179 -0.951 . . . . 0.0 109.472 178.763 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.654 ' N ' HH12 ' A' ' 19' ' ' ARG . 10.1 p -92.37 137.45 24.64 Favored Pre-proline 0 N--CA 1.491 1.608 0 O-C-N 121.319 -0.863 . . . . 0.0 109.416 -178.997 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -69.89 -16.69 37.09 Favored 'Trans proline' 0 C--N 1.304 -1.794 0 C-N-CA 122.783 2.322 . . . . 0.0 112.262 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.492 ' C ' HD22 ' A' ' 13' ' ' LEU . . . -60.22 -31.76 70.47 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.297 -0.877 . . . . 0.0 109.484 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.626 HD22 ' N ' ' A' ' 13' ' ' LEU . 3.7 mm? -95.39 154.44 39.37 Favored Pre-proline 0 N--CA 1.491 1.604 0 O-C-N 121.346 -0.846 . . . . 0.0 109.477 179.825 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -55.42 144.13 74.19 Favored 'Trans proline' 0 C--N 1.306 -1.704 0 C-N-CA 122.798 2.332 . . . . 0.0 112.165 179.702 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -49.18 129.15 17.72 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.268 -0.895 . . . . 0.0 109.485 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 118.04 -19.89 10.86 Favored Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.594 -1.403 . . . . 0.0 109.594 -179.79 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' TRP . . . . . 0.406 ' CZ2' HD11 ' A' ' 55' ' ' LEU . 20.7 m95 -85.09 144.09 28.45 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.232 -1.158 . . . . 0.0 109.45 -179.903 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -144.63 157.06 44.37 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.253 -0.904 . . . . 0.0 109.477 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.654 HH12 ' N ' ' A' ' 10' ' ' CYS . 32.8 ptt-85 -147.25 152.54 38.48 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.179 -0.951 . . . . 0.0 109.381 179.502 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.401 ' O ' ' CD ' ' A' ' 20' ' ' GLU . 0.0 OUTLIER -150.61 151.0 31.89 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.28 -0.888 . . . . 0.0 109.526 -179.499 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.425 ' OE1' ' CE ' ' A' ' 6' ' ' LYS . 86.4 tt0 -96.57 146.06 25.16 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.268 -0.895 . . . . 0.0 109.326 179.184 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.8 t -144.43 122.79 6.82 Favored Pre-proline 0 N--CA 1.49 1.554 0 O-C-N 121.245 -0.909 . . . . 0.0 109.523 -178.919 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -75.76 136.51 18.99 Favored 'Trans proline' 0 C--N 1.306 -1.693 0 C-N-CA 122.828 2.352 . . . . 0.0 112.214 179.451 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 95.1 mtt-85 . . . . . 0 N--CA 1.488 1.469 0 O-C-N 121.18 -0.95 . . . . 0.0 109.534 -179.676 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 37.7 m80 . . . . . 0 N--CA 1.489 1.52 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.39 139.49 52.73 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.234 -0.916 . . . . 0.0 109.385 -179.837 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.564 ' OD1' ' N ' ' A' ' 35' ' ' VAL . 67.3 t0 -119.37 142.01 48.54 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.269 -0.894 . . . . 0.0 109.455 -179.711 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.564 ' N ' ' OD1' ' A' ' 34' ' ' ASP . 62.7 t -110.58 140.82 27.99 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.246 -0.909 . . . . 0.0 109.397 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 65.0 m-85 -122.52 149.98 43.19 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.245 -0.91 . . . . 0.0 109.498 -179.523 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.562 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 22.3 m-85 -116.58 145.22 43.53 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.289 -0.882 . . . . 0.0 109.408 -179.884 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -120.5 134.87 55.22 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.209 -0.932 . . . . 0.0 109.445 -179.369 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.503 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -97.6 -179.56 0.9 Allowed Pre-proline 0 N--CA 1.491 1.586 0 O-C-N 121.301 -0.875 . . . . 0.0 109.358 179.221 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.503 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 39.2 Cg_exo -56.86 -28.97 79.69 Favored 'Trans proline' 0 C--N 1.306 -1.671 0 C-N-CA 122.836 2.357 . . . . 0.0 112.151 -179.633 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 94.1 p -91.44 2.48 56.38 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.261 -0.899 . . . . 0.0 109.518 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 83.45 14.78 72.95 Favored Glycine 0 N--CA 1.49 2.243 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 179.909 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -70.91 123.98 23.28 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.293 -1.122 . . . . 0.0 109.404 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.675 ' NZ ' HH22 ' A' ' 46' ' ' ARG . 18.6 pttp -95.32 129.6 42.4 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.216 -0.927 . . . . 0.0 109.48 179.202 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.659 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 0.7 OUTLIER -140.52 147.85 40.16 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.316 -0.865 . . . . 0.0 109.431 -179.837 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.675 HH22 ' NZ ' ' A' ' 44' ' ' LYS . 6.2 ptp85 -134.06 57.43 1.81 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.288 -0.882 . . . . 0.0 109.466 179.664 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -150.73 132.48 14.97 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.217 -0.927 . . . . 0.0 109.524 -179.78 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.722 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 2.7 tmtm? -71.25 -39.37 7.9 Favored Pre-proline 0 N--CA 1.491 1.593 0 O-C-N 121.319 -0.863 . . . . 0.0 109.488 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.722 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 33.0 Cg_exo -57.6 -55.17 2.61 Favored 'Trans proline' 0 C--N 1.306 -1.699 0 C-N-CA 122.894 2.396 . . . . 0.0 112.181 -179.556 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 26.7 tt0 -69.34 -31.83 70.53 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.274 -0.891 . . . . 0.0 109.474 179.437 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.754 HD23 ' C ' ' A' ' 51' ' ' LEU . 6.6 tt -67.78 -51.79 44.78 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.271 -0.893 . . . . 0.0 109.525 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.678 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -65.11 -42.74 93.7 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.163 -0.96 . . . . 0.0 109.511 179.885 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 80.3 mmt-85 -62.48 -37.89 87.71 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.269 -0.894 . . . . 0.0 109.521 -179.56 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 33.2 t80 -59.75 -51.66 68.8 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.313 -0.867 . . . . 0.0 109.445 -179.57 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.427 ' C ' ' N ' ' A' ' 57' ' ' GLY . 79.0 mt -100.3 5.63 44.54 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.24 -0.913 . . . . 0.0 109.517 179.683 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLY . . . . . 0.678 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -52.72 -10.94 1.11 Allowed Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 -179.202 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' GLY . . . . . 0.427 ' N ' ' C ' ' A' ' 55' ' ' LEU . . . -106.22 -50.12 0.89 Allowed Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.556 -1.417 . . . . 0.0 109.556 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 95.1 p -63.64 -24.25 67.71 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.288 -1.125 . . . . 0.0 109.531 -179.544 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 2.1 mmm -169.77 163.42 9.83 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.23 -0.919 . . . . 0.0 109.405 -179.709 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 49.7 t0 -95.37 114.89 26.71 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.222 -0.924 . . . . 0.0 109.465 179.636 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 95.2 mt -110.61 7.05 22.25 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.227 -0.921 . . . . 0.0 109.467 -179.408 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 33.4 t -51.93 -32.05 31.38 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.2 -0.938 . . . . 0.0 109.437 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 24.2 p -91.99 14.31 16.15 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.238 -0.914 . . . . 0.0 109.452 -179.499 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.525 ' O ' ' NZ ' ' A' ' 48' ' ' LYS . 84.0 t80 -89.7 123.56 33.83 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.248 -0.908 . . . . 0.0 109.44 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 82.4 m-20 -78.59 124.19 27.9 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.325 -0.86 . . . . 0.0 109.448 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.562 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 77.5 t80 -77.45 -43.18 33.28 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.293 -0.879 . . . . 0.0 109.486 179.445 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.22 -45.39 94.77 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.286 -0.884 . . . . 0.0 109.459 -178.923 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 76.0 p -92.49 -17.85 23.96 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.274 -0.891 . . . . 0.0 109.5 -179.089 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 62.85 28.59 72.07 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.504 -1.438 . . . . 0.0 109.504 -179.684 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 64.4 mttp -125.25 153.49 43.11 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.324 -1.103 . . . . 0.0 109.44 -179.436 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.419 ' HB2' ' HB2' ' A' ' 12' ' ' ALA . 24.7 ttm -90.65 126.43 35.97 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.272 -0.893 . . . . 0.0 109.514 -179.745 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.444 HD23 ' C ' ' A' ' 72' ' ' LEU . 1.6 tt . . . . . 0 N--CA 1.489 1.517 0 O-C-N 121.171 -0.956 . . . . 0.0 109.527 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.449 ' NE ' ' OE2' ' A' ' 20' ' ' GLU . 79.3 mtp180 . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 121.352 0.596 . . . . 0.0 109.421 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.457 ' HB3' ' CH2' ' A' ' 8' ' ' TRP . 59.8 mttt -82.9 168.83 16.69 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.183 -0.948 . . . . 0.0 109.472 -179.303 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.426 ' HG2' ' O ' ' A' ' 6' ' ' LYS . 22.7 mmt180 -146.57 138.01 24.45 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.154 -0.967 . . . . 0.0 109.455 -178.179 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.468 ' HE1' ' HB2' ' A' ' 21' ' ' GLU . 12.4 m95 -123.61 118.16 26.68 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.228 -0.92 . . . . 0.0 109.489 179.088 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 -78.41 148.83 33.47 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.22 -0.925 . . . . 0.0 109.518 178.554 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.536 ' SG ' ' NE ' ' A' ' 19' ' ' ARG . 20.8 p -135.13 101.5 11.29 Favored Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.155 -0.966 . . . . 0.0 109.494 -179.278 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -73.54 -11.44 24.36 Favored 'Trans proline' 0 C--N 1.305 -1.761 0 C-N-CA 122.836 2.358 . . . . 0.0 112.224 179.227 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.513 ' C ' HD22 ' A' ' 13' ' ' LEU . . . -80.21 -21.14 43.23 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.221 -0.924 . . . . 0.0 109.409 178.938 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.566 HD22 ' N ' ' A' ' 13' ' ' LEU . 3.3 mm? -98.94 156.78 35.13 Favored Pre-proline 0 N--CA 1.489 1.499 0 O-C-N 121.198 -0.939 . . . . 0.0 109.43 179.544 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -52.79 147.51 31.68 Favored 'Trans proline' 0 C--N 1.305 -1.736 0 C-N-CA 122.838 2.359 . . . . 0.0 112.263 178.867 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 27.3 mm100 -56.64 125.47 22.39 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.232 -0.917 . . . . 0.0 109.507 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 124.54 -18.9 7.18 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.57 -1.412 . . . . 0.0 109.57 179.732 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' TRP . . . . . 0.406 ' HB3' HH21 ' A' ' 19' ' ' ARG . 47.9 m95 -91.21 137.35 32.43 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.237 -1.154 . . . . 0.0 109.441 179.319 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -146.58 162.35 38.57 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.236 -0.915 . . . . 0.0 109.485 -179.151 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.536 ' NE ' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -123.04 160.24 26.73 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.274 -0.892 . . . . 0.0 109.473 178.812 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.449 ' OE2' ' NE ' ' A' ' 5' ' ' ARG . 75.6 tt0 -145.11 134.82 23.45 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.29 -0.881 . . . . 0.0 109.464 -179.082 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.533 ' CD ' HG22 ' A' ' 35' ' ' VAL . 4.0 tp10 -103.95 129.97 51.54 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.21 -0.931 . . . . 0.0 109.35 178.191 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.0 t -134.12 99.21 13.68 Favored Pre-proline 0 N--CA 1.489 1.476 0 O-C-N 121.271 -0.893 . . . . 0.0 109.593 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -58.03 135.19 67.08 Favored 'Trans proline' 0 C--N 1.304 -1.796 0 C-N-CA 122.858 2.372 . . . . 0.0 112.122 178.105 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.427 HH11 ' HD2' ' A' ' 24' ' ' ARG . 20.8 ttm105 . . . . . 0 N--CA 1.489 1.505 0 O-C-N 121.231 -0.918 . . . . 0.0 109.464 179.619 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 71.0 m80 . . . . . 0 N--CA 1.489 1.522 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 37.2 ptt-85 -117.26 138.86 51.45 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.343 -0.848 . . . . 0.0 109.481 179.759 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -100.68 138.45 37.72 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.243 -0.911 . . . . 0.0 109.452 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.533 HG22 ' CD ' ' A' ' 21' ' ' GLU . 37.6 t -110.04 134.62 51.6 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.304 -0.872 . . . . 0.0 109.437 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -119.55 145.06 46.7 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.289 -0.882 . . . . 0.0 109.478 179.586 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.689 ' CE1' ' CZ ' ' A' ' 66' ' ' PHE . 7.7 m-85 -114.84 145.27 42.34 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.267 -0.895 . . . . 0.0 109.4 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -123.68 135.52 53.94 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.34 -0.85 . . . . 0.0 109.608 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.457 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -98.21 177.96 1.46 Allowed Pre-proline 0 N--CA 1.49 1.533 0 O-C-N 121.28 -0.888 . . . . 0.0 109.467 179.325 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.457 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 50.0 Cg_exo -55.08 -32.95 81.83 Favored 'Trans proline' 0 C--N 1.305 -1.731 0 C-N-CA 122.82 2.347 . . . . 0.0 112.339 179.862 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 41.1 t -87.52 4.35 43.87 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.341 -0.849 . . . . 0.0 109.494 -179.773 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 82.09 16.15 72.86 Favored Glycine 0 N--CA 1.489 2.175 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 -179.743 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -70.25 119.62 14.71 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.29 -1.123 . . . . 0.0 109.509 179.823 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.443 ' O ' ' HG3' ' A' ' 44' ' ' LYS . 24.3 pttm -94.8 125.03 39.19 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.235 -0.916 . . . . 0.0 109.494 178.873 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 31.8 p90 -141.48 149.04 40.4 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.214 -0.929 . . . . 0.0 109.557 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 26.5 ptt-85 -133.91 60.78 1.69 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.178 -0.951 . . . . 0.0 109.439 179.847 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.2 m -155.62 138.83 15.63 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.243 -0.911 . . . . 0.0 109.469 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.606 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 2.3 tttm -65.9 -45.8 64.65 Favored Pre-proline 0 N--CA 1.49 1.536 0 O-C-N 121.245 -0.909 . . . . 0.0 109.41 -179.719 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.606 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 49.0 Cg_exo -54.97 -44.4 50.13 Favored 'Trans proline' 0 C--N 1.306 -1.679 0 C-N-CA 122.84 2.36 . . . . 0.0 112.228 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -67.78 -38.15 83.0 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.236 -0.915 . . . . 0.0 109.444 179.816 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 55.3 tp -65.87 -45.8 80.77 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.31 -0.869 . . . . 0.0 109.397 -179.329 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.707 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -69.02 -44.56 72.48 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.302 -0.874 . . . . 0.0 109.529 -179.648 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 7.9 tpt180 -60.22 -43.3 96.13 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.267 -0.896 . . . . 0.0 109.456 -179.474 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 25.9 t80 -62.64 -52.86 61.68 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.181 -0.95 . . . . 0.0 109.451 -179.301 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.406 HD23 ' HA ' ' A' ' 55' ' ' LEU . 97.6 mt -90.9 2.53 56.12 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.271 -0.893 . . . . 0.0 109.464 179.78 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLY . . . . . 0.707 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -45.06 -78.13 0.08 OUTLIER Glycine 0 N--CA 1.491 2.359 0 N-CA-C 109.471 -1.452 . . . . 0.0 109.471 -179.913 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.32 7.47 0.22 Allowed Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 -179.564 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.563 ' H ' ' C ' ' A' ' 56' ' ' GLY . 3.0 m -104.19 -27.03 12.29 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.228 -1.16 . . . . 0.0 109.533 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.671 ' SD ' HD11 ' A' ' 61' ' ' LEU . 1.7 ptp 178.1 171.25 0.7 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.253 -0.905 . . . . 0.0 109.48 -179.463 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 59.6 t0 -93.56 111.44 23.11 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.194 -0.942 . . . . 0.0 109.397 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.671 HD11 ' SD ' ' A' ' 59' ' ' MET . 10.7 mp -99.73 5.1 45.71 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.239 -0.913 . . . . 0.0 109.428 -179.921 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 23.4 m -46.16 -38.78 8.68 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.279 -0.888 . . . . 0.0 109.462 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 55.8 p -95.35 49.65 1.21 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.301 -0.874 . . . . 0.0 109.4 179.315 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 65.9 t80 -116.61 132.16 56.76 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.302 -0.874 . . . . 0.0 109.477 -179.576 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 91.8 m-20 -93.42 107.75 19.53 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.188 -0.945 . . . . 0.0 109.544 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.689 ' CZ ' ' CE1' ' A' ' 37' ' ' TYR . 53.2 t80 -75.43 -40.36 57.78 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.339 -0.851 . . . . 0.0 109.465 -179.723 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 27.9 mmt180 -62.05 -32.89 73.45 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.282 -0.886 . . . . 0.0 109.464 -179.592 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 16.1 p -95.22 -15.23 23.4 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.258 -0.901 . . . . 0.0 109.486 -179.389 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 67.12 27.02 73.34 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.579 -1.408 . . . . 0.0 109.579 -179.608 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -138.19 158.0 45.17 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.198 -1.178 . . . . 0.0 109.47 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.427 ' O ' ' C ' ' A' ' 72' ' ' LEU . 19.9 ttm -91.35 132.76 35.97 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.192 -0.942 . . . . 0.0 109.543 -179.763 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.427 ' C ' ' O ' ' A' ' 71' ' ' MET . 56.1 tp . . . . . 0 N--CA 1.49 1.567 0 O-C-N 121.281 -0.887 . . . . 0.0 109.528 -179.532 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 84.0 mtt85 . . . . . 0 N--CA 1.49 1.568 0 CA-C-O 121.317 0.58 . . . . 0.0 109.512 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.421 ' HB2' ' CZ3' ' A' ' 8' ' ' TRP . 26.1 mmtp -100.32 98.04 8.74 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.159 -0.963 . . . . 0.0 109.532 179.786 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.597 HH21 ' CD ' ' A' ' 18' ' ' GLU . 85.2 mtp180 -70.66 166.2 21.28 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.173 -0.954 . . . . 0.0 109.465 -179.405 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.491 ' CG ' ' O ' ' A' ' 7' ' ' ARG . 1.3 m0 -165.8 141.9 5.15 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.235 -0.916 . . . . 0.0 109.542 -179.474 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -111.29 139.59 46.56 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.247 -0.908 . . . . 0.0 109.493 179.256 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.7 t -127.58 140.6 38.49 Favored Pre-proline 0 N--CA 1.49 1.567 0 O-C-N 121.247 -0.908 . . . . 0.0 109.505 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -51.11 -31.79 37.05 Favored 'Trans proline' 0 C--N 1.305 -1.756 0 C-N-CA 122.812 2.342 . . . . 0.0 112.157 179.333 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.407 ' HB2' ' HB2' ' A' ' 71' ' ' MET . . . -76.89 -10.73 59.57 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.164 -0.96 . . . . 0.0 109.462 -179.492 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.6 mp -90.43 116.17 65.79 Favored Pre-proline 0 N--CA 1.49 1.567 0 O-C-N 121.243 -0.911 . . . . 0.0 109.495 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' PRO . . . . . 0.415 ' O ' ' C ' ' A' ' 15' ' ' GLN . 48.6 Cg_exo -51.04 141.93 35.98 Favored 'Trans proline' 0 C--N 1.305 -1.725 0 C-N-CA 122.832 2.355 . . . . 0.0 112.244 -179.551 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.415 ' C ' ' O ' ' A' ' 14' ' ' PRO . 0.0 OUTLIER -44.64 107.17 0.09 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.249 -0.907 . . . . 0.0 109.523 -179.498 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 127.13 -23.87 5.45 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 178.725 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 24.1 m95 -80.04 139.13 37.07 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.215 -1.168 . . . . 0.0 109.46 178.748 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.597 ' CD ' HH21 ' A' ' 7' ' ' ARG . 97.0 mt-10 -127.95 150.47 49.88 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.248 -0.908 . . . . 0.0 109.432 -178.089 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.402 ' NH1' ' HA3' ' A' ' 69' ' ' GLY . 53.8 ttp180 -128.16 149.89 50.24 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.219 -0.926 . . . . 0.0 109.493 177.807 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 18.8 pt-20 -156.07 141.02 17.25 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.288 -0.883 . . . . 0.0 109.496 -179.226 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 79.6 tt0 -98.49 133.04 43.41 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.229 -0.919 . . . . 0.0 109.352 178.458 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.6 t -139.78 103.46 6.95 Favored Pre-proline 0 N--CA 1.49 1.559 0 O-C-N 121.182 -0.948 . . . . 0.0 109.533 -178.83 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' PRO . . . . . 0.416 ' HA ' ' HA ' ' A' ' 33' ' ' ARG . 47.1 Cg_exo -55.38 129.34 34.67 Favored 'Trans proline' 0 C--N 1.305 -1.715 0 C-N-CA 122.881 2.387 . . . . 0.0 112.203 178.685 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 . . . . . 0 N--CA 1.49 1.572 0 O-C-N 121.203 -0.936 . . . . 0.0 109.476 179.716 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 52.8 m-70 . . . . . 0 N--CA 1.489 1.521 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.416 ' HA ' ' HA ' ' A' ' 23' ' ' PRO . 99.6 mtt180 -53.67 132.39 40.76 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.229 -0.919 . . . . 0.0 109.458 179.555 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.607 ' OD1' ' N ' ' A' ' 35' ' ' VAL . 66.8 t0 -125.64 149.37 48.48 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.34 -0.85 . . . . 0.0 109.433 179.493 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.607 ' N ' ' OD1' ' A' ' 34' ' ' ASP . 64.0 t -117.06 133.75 62.82 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 O-C-N 121.247 -0.908 . . . . 0.0 109.469 -179.113 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.406 ' CZ ' ' OD2' ' A' ' 34' ' ' ASP . 96.7 m-85 -122.56 146.05 47.77 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.287 -0.883 . . . . 0.0 109.468 179.19 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.462 ' HB2' ' CE2' ' A' ' 45' ' ' PHE . 41.5 m-85 -116.07 151.34 35.74 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.262 -0.899 . . . . 0.0 109.501 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 67.5 m-85 -126.07 136.77 53.32 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.324 -0.86 . . . . 0.0 109.508 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.477 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.4 OUTLIER -98.05 178.98 1.17 Allowed Pre-proline 0 N--CA 1.49 1.547 0 O-C-N 121.285 -0.884 . . . . 0.0 109.433 179.695 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.477 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 43.0 Cg_exo -55.67 -30.21 74.35 Favored 'Trans proline' 0 C--N 1.304 -1.802 0 C-N-CA 122.779 2.32 . . . . 0.0 112.212 -179.831 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 99.8 p -87.37 4.07 44.52 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.225 -0.922 . . . . 0.0 109.488 -179.567 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 77.61 17.09 79.43 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.557 -1.417 . . . . 0.0 109.557 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.25 125.52 29.58 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.276 -1.132 . . . . 0.0 109.493 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 24.8 pttm -92.29 135.52 33.95 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.3 -0.875 . . . . 0.0 109.475 179.784 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.588 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 1.3 p90 -140.34 146.92 39.09 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.262 -0.899 . . . . 0.0 109.416 179.714 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 19.0 ttm180 -131.56 59.36 1.7 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.241 -0.912 . . . . 0.0 109.548 179.296 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -160.92 141.65 11.47 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.234 -0.916 . . . . 0.0 109.421 -179.725 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.735 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 16.9 tptm -69.92 -37.92 8.5 Favored Pre-proline 0 N--CA 1.49 1.574 0 O-C-N 121.291 -0.881 . . . . 0.0 109.474 -179.291 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.735 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 33.6 Cg_exo -61.21 -51.24 4.68 Favored 'Trans proline' 0 C--N 1.305 -1.728 0 C-N-CA 122.866 2.378 . . . . 0.0 112.224 179.554 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -64.77 -34.9 79.42 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.257 -0.902 . . . . 0.0 109.463 179.465 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.542 ' O ' HD23 ' A' ' 51' ' ' LEU . 5.6 tt -62.44 -48.36 80.0 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.242 -0.911 . . . . 0.0 109.405 -179.759 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -69.91 -42.62 73.11 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.267 -0.896 . . . . 0.0 109.438 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 61.5 ttp180 -59.05 -41.37 87.76 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.389 -0.819 . . . . 0.0 109.539 179.453 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 50.4 t80 -60.0 -54.49 45.4 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.218 -0.926 . . . . 0.0 109.454 -179.666 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.511 HD12 HD22 ' A' ' 61' ' ' LEU . 36.3 mt -63.62 -42.07 98.22 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.199 -0.938 . . . . 0.0 109.473 179.821 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 72.73 -139.76 27.97 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -84.86 -0.1 89.11 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 78.0 p -66.43 -32.84 74.47 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.216 -1.167 . . . . 0.0 109.429 -179.744 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 44.4 mmm -144.42 135.78 25.5 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.213 -0.929 . . . . 0.0 109.469 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.578 ' C ' HD12 ' A' ' 61' ' ' LEU . 39.7 p-10 -93.13 112.3 24.2 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.231 -0.918 . . . . 0.0 109.551 179.326 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.578 HD12 ' C ' ' A' ' 60' ' ' ASP . 9.7 mp -117.67 14.14 14.36 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.153 -0.967 . . . . 0.0 109.507 -179.246 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 83.3 p -49.38 -34.82 17.09 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.201 -0.937 . . . . 0.0 109.49 179.784 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 40.3 p -100.33 36.06 1.96 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.234 -0.916 . . . . 0.0 109.435 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 80.2 t80 -105.71 129.14 53.99 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.274 -0.891 . . . . 0.0 109.497 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 55.1 t0 -86.68 118.77 26.3 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.3 -0.875 . . . . 0.0 109.456 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 65.3 t80 -81.44 -37.57 27.84 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.245 -0.909 . . . . 0.0 109.463 -179.519 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.416 HH11 ' HD3' ' A' ' 67' ' ' ARG . 24.4 mmt180 -63.95 -43.32 96.19 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.201 -0.937 . . . . 0.0 109.483 -179.054 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 71.1 p -95.61 -19.74 19.52 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.294 -0.879 . . . . 0.0 109.483 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' GLY . . . . . 0.402 ' HA3' ' NH1' ' A' ' 19' ' ' ARG . . . 67.57 53.14 26.0 Favored Glycine 0 N--CA 1.489 2.232 0 N-CA-C 109.549 -1.421 . . . . 0.0 109.549 178.943 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 19.8 ptmt -150.3 151.77 33.46 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.199 -1.177 . . . . 0.0 109.433 179.303 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.407 ' HB2' ' HB2' ' A' ' 12' ' ' ALA . 38.1 ttm -95.22 124.81 39.45 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.22 -0.925 . . . . 0.0 109.494 -179.738 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 60.5 tp . . . . . 0 N--CA 1.49 1.553 0 O-C-N 121.262 -0.899 . . . . 0.0 109.472 -179.603 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 66.7 ttp85 . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 40.1 mttt -103.54 107.7 18.65 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.176 -0.952 . . . . 0.0 109.442 -179.861 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 3.4 ptp180 -70.07 167.01 18.57 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.241 -0.912 . . . . 0.0 109.487 -179.466 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.849 ' HE1' ' H ' ' A' ' 21' ' ' GLU . 60.9 m95 -143.33 129.42 19.69 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.246 -0.909 . . . . 0.0 109.499 179.827 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -58.06 139.12 55.28 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.25 -0.907 . . . . 0.0 109.546 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -71.16 126.92 91.98 Favored Pre-proline 0 N--CA 1.491 1.589 0 O-C-N 121.237 -0.915 . . . . 0.0 109.456 -179.717 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -74.06 -59.72 0.05 OUTLIER 'Trans proline' 0 C--N 1.303 -1.818 0 C-N-CA 122.823 2.348 . . . . 0.0 112.198 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.489 ' CB ' ' SD ' ' A' ' 71' ' ' MET . . . -116.28 -28.95 6.37 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.325 -0.859 . . . . 0.0 109.476 179.322 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.462 ' C ' ' O ' ' A' ' 12' ' ' ALA . 5.3 mp -40.7 157.49 0.18 Allowed Pre-proline 0 N--CA 1.491 1.608 0 O-C-N 121.177 -0.952 . . . . 0.0 109.462 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' PRO . . . . . 0.501 ' HG2' ' CD1' ' A' ' 17' ' ' TRP . 34.0 Cg_endo -66.29 151.69 82.8 Favored 'Trans proline' 0 C--N 1.305 -1.746 0 C-N-CA 122.836 2.358 . . . . 0.0 112.205 179.042 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -58.58 123.45 16.31 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.268 -0.895 . . . . 0.0 109.498 -178.518 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 125.69 -27.14 5.26 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.489 -1.444 . . . . 0.0 109.489 178.419 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' TRP . . . . . 0.51 ' CZ2' HD21 ' A' ' 55' ' ' LEU . 15.5 m95 -84.78 143.23 29.25 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.235 -1.156 . . . . 0.0 109.441 179.585 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 75.1 tt0 -136.13 151.85 50.2 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.261 -0.899 . . . . 0.0 109.544 -178.838 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.494 HH11 ' HD2' ' A' ' 19' ' ' ARG . 26.5 mtm105 -121.88 163.25 19.55 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.242 -0.911 . . . . 0.0 109.445 178.373 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -155.78 128.53 7.92 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.214 -0.929 . . . . 0.0 109.492 -179.513 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.849 ' H ' ' HE1' ' A' ' 8' ' ' TRP . 92.0 mt-10 -89.8 134.19 34.32 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.278 -0.889 . . . . 0.0 109.324 178.858 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.524 ' O ' ' OD1' ' A' ' 34' ' ' ASP . 25.5 t -137.25 100.43 9.49 Favored Pre-proline 0 N--CA 1.49 1.557 0 O-C-N 121.225 -0.922 . . . . 0.0 109.61 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_exo -54.6 131.35 45.18 Favored 'Trans proline' 0 C--N 1.304 -1.789 0 C-N-CA 122.822 2.348 . . . . 0.0 112.207 179.001 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 84.4 mtp180 . . . . . 0 N--CA 1.491 1.588 0 O-C-N 121.206 -0.934 . . . . 0.0 109.53 179.602 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 30.3 m170 . . . . . 0 N--CA 1.49 1.542 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -113.24 133.15 55.23 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.274 -0.891 . . . . 0.0 109.556 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.524 ' OD1' ' O ' ' A' ' 22' ' ' VAL . 7.5 p30 -104.25 136.65 43.46 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.352 -0.843 . . . . 0.0 109.484 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.402 HG22 ' HG2' ' A' ' 21' ' ' GLU . 38.9 t -110.79 134.78 51.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.358 -0.839 . . . . 0.0 109.477 179.317 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -114.36 149.49 36.02 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.294 -0.878 . . . . 0.0 109.516 -179.616 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.563 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 17.1 m-85 -118.83 149.82 40.88 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.197 -0.939 . . . . 0.0 109.467 179.515 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.436 ' CD1' ' N ' ' A' ' 38' ' ' TYR . 15.0 m-85 -129.86 140.3 51.02 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.184 -0.947 . . . . 0.0 109.616 -179.696 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.43 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -109.74 176.94 1.36 Allowed Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.266 -0.896 . . . . 0.0 109.403 179.665 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.43 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 52.2 Cg_exo -53.26 -33.27 64.53 Favored 'Trans proline' 0 C--N 1.305 -1.741 0 C-N-CA 122.872 2.382 . . . . 0.0 112.246 179.551 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 20.9 t -76.41 -5.28 46.65 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.255 -0.903 . . . . 0.0 109.475 179.603 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 80.28 15.04 79.4 Favored Glycine 0 N--CA 1.489 2.206 0 N-CA-C 109.496 -1.442 . . . . 0.0 109.496 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -78.24 124.86 28.56 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.273 -1.134 . . . . 0.0 109.461 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.8 ptmm? -95.16 121.6 36.97 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.256 -0.903 . . . . 0.0 109.586 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -142.71 155.04 44.83 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.268 -0.895 . . . . 0.0 109.477 178.852 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.72 ' O ' ' C ' ' A' ' 47' ' ' SER . 5.0 ptt180 -130.77 -66.71 0.75 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.271 -0.893 . . . . 0.0 109.491 179.16 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.72 ' C ' ' O ' ' A' ' 46' ' ' ARG . 1.7 m -15.82 125.91 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.337 -0.852 . . . . 0.0 109.559 179.226 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.621 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 5.1 tmtp? -59.58 -45.56 98.7 Favored Pre-proline 0 N--CA 1.491 1.617 0 O-C-N 121.296 -0.877 . . . . 0.0 109.408 -179.646 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.621 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 52.5 Cg_exo -53.85 -46.08 36.28 Favored 'Trans proline' 0 C--N 1.305 -1.755 0 C-N-CA 122.837 2.358 . . . . 0.0 112.208 -179.42 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -66.41 -35.74 81.08 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.281 -0.887 . . . . 0.0 109.536 179.347 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 62.3 tp -63.04 -45.32 92.85 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.279 -0.888 . . . . 0.0 109.477 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.627 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -67.27 -40.58 86.18 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.174 -0.954 . . . . 0.0 109.472 -179.5 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 82.6 mtp180 -60.88 -42.14 97.37 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.331 -0.855 . . . . 0.0 109.517 -179.424 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 24.5 t80 -60.99 -53.83 52.45 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.189 -0.944 . . . . 0.0 109.464 -179.713 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.521 ' O ' ' N ' ' A' ' 57' ' ' GLY . 93.2 mt -88.13 1.89 53.3 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.29 -0.881 . . . . 0.0 109.504 179.356 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLY . . . . . 0.627 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -44.67 94.69 0.01 OUTLIER Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.46 -1.456 . . . . 0.0 109.46 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' GLY . . . . . 0.521 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . 125.05 -52.33 0.8 Allowed Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.465 -1.454 . . . . 0.0 109.465 179.837 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.1 m -63.0 -34.6 77.89 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.213 -1.169 . . . . 0.0 109.454 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 51.6 ttp -163.98 157.81 18.92 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.251 -0.906 . . . . 0.0 109.465 -179.576 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.403 ' C ' HD22 ' A' ' 61' ' ' LEU . 51.4 t0 -89.38 110.26 21.09 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.252 -0.905 . . . . 0.0 109.512 -179.688 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.534 HD22 ' N ' ' A' ' 61' ' ' LEU . 4.0 mm? -93.78 -3.76 51.51 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.267 -0.896 . . . . 0.0 109.469 -179.733 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 38.4 t -59.45 -39.49 83.77 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.216 -0.927 . . . . 0.0 109.395 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 65.9 p -86.71 14.55 6.87 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.182 -0.949 . . . . 0.0 109.424 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -91.55 129.64 37.5 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.177 -0.952 . . . . 0.0 109.462 -179.836 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.52 ' O ' ' N ' ' A' ' 69' ' ' GLY . 60.9 t0 -80.03 112.19 17.1 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.196 -0.94 . . . . 0.0 109.472 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.563 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 48.2 t80 -75.13 -44.15 48.59 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.233 -0.917 . . . . 0.0 109.468 -179.006 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.418 ' HD2' ' N ' ' A' ' 67' ' ' ARG . 10.9 mpt_? -60.34 -42.52 95.88 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.198 -0.939 . . . . 0.0 109.518 -178.794 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' THR . . . . . 0.482 ' OG1' ' CG ' ' A' ' 65' ' ' ASP . 30.0 p -97.83 -13.85 21.08 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.302 -0.874 . . . . 0.0 109.497 -179.459 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' GLY . . . . . 0.52 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 63.25 39.47 97.92 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.481 -1.448 . . . . 0.0 109.481 -179.841 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.438 ' H ' ' HB3' ' A' ' 65' ' ' ASP . 51.4 mttp -137.35 156.55 48.09 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.223 -1.163 . . . . 0.0 109.461 -179.487 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.489 ' SD ' ' CB ' ' A' ' 12' ' ' ALA . 37.2 mtt -84.95 148.47 26.2 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.199 -0.938 . . . . 0.0 109.442 -180.0 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 56.0 tp . . . . . 0 N--CA 1.49 1.546 0 O-C-N 121.282 -0.886 . . . . 0.0 109.446 179.967 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 35.3 ptt180 . . . . . 0 N--CA 1.489 1.517 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.437 ' N ' ' HD3' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -114.39 113.09 24.05 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.244 -0.91 . . . . 0.0 109.442 179.883 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.52 ' NH2' ' OE1' ' A' ' 18' ' ' GLU . 69.4 mtp85 -72.01 168.06 18.84 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.273 -0.892 . . . . 0.0 109.38 -179.932 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.59 ' N ' ' O ' ' A' ' 19' ' ' ARG . 53.0 m95 -136.28 124.7 23.42 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.197 -0.939 . . . . 0.0 109.427 -179.418 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.521 ' N ' ' OE1' ' A' ' 9' ' ' GLU . 58.5 mp0 -90.78 117.07 29.12 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.279 -0.888 . . . . 0.0 109.398 179.769 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.419 ' SG ' ' HB3' ' A' ' 12' ' ' ALA . 46.4 t -119.24 100.32 50.15 Favored Pre-proline 0 N--CA 1.491 1.608 0 O-C-N 121.34 -0.85 . . . . 0.0 109.522 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_exo -55.2 -25.44 46.38 Favored 'Trans proline' 0 C--N 1.305 -1.749 0 C-N-CA 122.945 2.43 . . . . 0.0 112.19 178.955 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.455 ' HB1' ' SD ' ' A' ' 71' ' ' MET . . . -57.45 -35.08 69.65 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.267 -0.895 . . . . 0.0 109.47 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.671 HD22 ' N ' ' A' ' 13' ' ' LEU . 3.2 mm? -89.97 154.9 47.64 Favored Pre-proline 0 N--CA 1.49 1.555 0 O-C-N 121.201 -0.937 . . . . 0.0 109.402 179.793 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_exo -52.1 146.7 29.4 Favored 'Trans proline' 0 C--N 1.306 -1.709 0 C-N-CA 122.78 2.32 . . . . 0.0 112.231 179.064 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 8.7 mp0 -55.29 124.08 15.89 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.252 -0.905 . . . . 0.0 109.509 -179.757 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 124.31 -22.47 6.64 Favored Glycine 0 N--CA 1.49 2.243 0 N-CA-C 109.647 -1.381 . . . . 0.0 109.647 179.427 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 52.4 m95 -85.36 136.16 33.59 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.177 -1.19 . . . . 0.0 109.473 179.205 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.52 ' OE1' ' NH2' ' A' ' 7' ' ' ARG . 72.4 mt-10 -142.41 155.7 45.14 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.326 -0.859 . . . . 0.0 109.424 -179.126 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.615 HH22 ' CD2' ' A' ' 13' ' ' LEU . 0.0 OUTLIER -138.56 140.24 38.97 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.211 -0.93 . . . . 0.0 109.399 178.953 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -132.89 142.59 49.0 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.241 -0.912 . . . . 0.0 109.481 -178.365 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.521 ' HG3' ' HE1' ' A' ' 8' ' ' TRP . 92.4 mt-10 -98.99 142.58 30.3 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.376 -0.827 . . . . 0.0 109.392 178.391 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 10.4 t -145.17 123.39 6.53 Favored Pre-proline 0 N--CA 1.491 1.598 0 O-C-N 121.219 -0.925 . . . . 0.0 109.611 -179.535 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -74.84 135.55 19.56 Favored 'Trans proline' 0 C--N 1.304 -1.813 0 C-N-CA 122.879 2.386 . . . . 0.0 112.214 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 78.3 mtp85 . . . . . 0 N--CA 1.49 1.569 0 O-C-N 121.273 -0.892 . . . . 0.0 109.484 179.652 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 33.2 m170 . . . . . 0 N--CA 1.49 1.539 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -114.98 128.04 56.04 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.245 -0.909 . . . . 0.0 109.518 -179.52 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 22.7 m-20 -106.92 137.42 45.01 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.211 -0.931 . . . . 0.0 109.419 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.426 HG22 ' HG2' ' A' ' 21' ' ' GLU . 3.0 t -106.91 135.03 46.83 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.246 -0.909 . . . . 0.0 109.411 179.577 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -113.7 141.54 47.11 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.313 -0.867 . . . . 0.0 109.524 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.709 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 17.5 m-85 -114.36 142.05 46.83 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.281 -0.887 . . . . 0.0 109.357 -179.352 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 86.2 m-85 -123.06 135.09 54.27 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.307 -0.871 . . . . 0.0 109.47 -179.607 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.454 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -97.2 177.56 1.63 Allowed Pre-proline 0 N--CA 1.491 1.592 0 O-C-N 121.191 -0.943 . . . . 0.0 109.426 179.593 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.454 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 47.4 Cg_exo -54.49 -31.37 68.78 Favored 'Trans proline' 0 C--N 1.304 -1.809 0 C-N-CA 122.848 2.365 . . . . 0.0 112.258 -179.656 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 71.8 m -88.62 7.08 35.21 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.316 -0.865 . . . . 0.0 109.476 179.561 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 79.95 10.7 85.33 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 -179.584 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -64.22 122.75 17.37 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.168 -1.195 . . . . 0.0 109.457 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 13.5 ptpt -95.88 126.88 41.44 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.242 -0.911 . . . . 0.0 109.525 178.9 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.634 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 1.1 p90 -139.92 146.46 39.24 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.296 -0.877 . . . . 0.0 109.47 -179.919 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 28.4 ptt-85 -134.79 53.59 1.98 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.3 -0.875 . . . . 0.0 109.549 179.213 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.4 p -159.41 144.71 15.77 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.285 -0.884 . . . . 0.0 109.563 -179.824 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.666 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 0.6 OUTLIER -69.39 -42.29 20.06 Favored Pre-proline 0 N--CA 1.49 1.545 0 O-C-N 121.211 -0.931 . . . . 0.0 109.4 -179.473 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.666 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 42.9 Cg_exo -57.54 -48.98 14.83 Favored 'Trans proline' 0 C--N 1.305 -1.752 0 C-N-CA 122.898 2.399 . . . . 0.0 112.231 -179.897 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -65.84 -38.07 87.89 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.275 -0.891 . . . . 0.0 109.388 179.54 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.516 HD13 ' CE2' ' A' ' 45' ' ' PHE . 37.0 tp -64.02 -45.41 89.02 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.274 -0.891 . . . . 0.0 109.493 -179.636 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.591 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -65.86 -43.98 86.77 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.262 -0.899 . . . . 0.0 109.425 -179.665 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 15.1 tpp180 -56.06 -42.88 77.33 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.251 -0.905 . . . . 0.0 109.448 -179.419 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 56.2 t80 -61.1 -52.14 66.17 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.207 -0.933 . . . . 0.0 109.387 -179.215 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.496 HD12 ' O ' ' A' ' 56' ' ' GLY . 2.5 pp -86.9 0.94 54.14 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.228 -0.92 . . . . 0.0 109.492 179.718 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLY . . . . . 0.591 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . 44.17 -121.8 4.06 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 -179.743 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -110.01 31.71 7.27 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.595 -1.402 . . . . 0.0 109.595 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 38.2 t -87.82 -21.11 25.25 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.228 -1.16 . . . . 0.0 109.458 -179.579 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 63.8 mmm -139.07 130.39 26.93 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.173 -0.954 . . . . 0.0 109.454 -179.64 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 63.0 t0 -90.79 106.38 18.47 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.272 -0.893 . . . . 0.0 109.479 179.191 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.416 ' O ' ' C ' ' A' ' 62' ' ' SER . 98.6 mt -93.47 4.44 53.95 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.23 -0.919 . . . . 0.0 109.487 -179.308 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.416 ' C ' ' O ' ' A' ' 61' ' ' LEU . 39.7 t -42.9 -39.71 2.66 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.285 -0.884 . . . . 0.0 109.484 179.577 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 67.9 p -98.57 48.39 0.98 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.238 -0.914 . . . . 0.0 109.417 179.345 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -124.25 131.0 53.5 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.299 -0.875 . . . . 0.0 109.482 -179.499 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.459 ' CG ' ' OG1' ' A' ' 68' ' ' THR . 55.7 t0 -89.94 104.59 17.14 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.125 -0.984 . . . . 0.0 109.463 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.709 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 68.2 t80 -74.16 -49.34 24.04 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.195 -0.94 . . . . 0.0 109.501 -179.231 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 19.0 mmm180 -51.43 -37.6 49.45 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.171 -0.956 . . . . 0.0 109.449 -179.624 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' THR . . . . . 0.459 ' OG1' ' CG ' ' A' ' 65' ' ' ASP . 22.3 p -100.45 -11.21 20.38 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.265 -0.897 . . . . 0.0 109.481 -179.881 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 62.12 34.23 88.37 Favored Glycine 0 N--CA 1.491 2.361 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 179.768 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 62.0 mttp -127.86 147.38 50.45 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.215 -1.167 . . . . 0.0 109.475 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.455 ' SD ' ' HB1' ' A' ' 12' ' ' ALA . 3.6 tpt -77.87 140.26 39.32 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.184 -0.947 . . . . 0.0 109.513 179.774 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 60.4 tp . . . . . 0 N--CA 1.49 1.548 0 O-C-N 121.222 -0.924 . . . . 0.0 109.458 179.87 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 88.1 mtm180 . . . . . 0 N--CA 1.49 1.552 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.532 ' HB2' ' H ' ' A' ' 21' ' ' GLU . 11.3 mptt -76.06 139.97 41.67 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.365 -0.835 . . . . 0.0 109.521 179.742 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -157.44 92.3 1.22 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.265 -0.897 . . . . 0.0 109.508 -179.558 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.657 ' HE1' ' HE ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -122.27 149.22 44.01 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.19 -0.944 . . . . 0.0 109.509 179.304 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -62.7 150.83 40.04 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.276 -0.89 . . . . 0.0 109.505 179.655 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.448 ' SG ' ' C ' ' A' ' 18' ' ' GLU . 10.9 m -93.45 114.3 62.51 Favored Pre-proline 0 N--CA 1.492 1.644 0 O-C-N 121.251 -0.906 . . . . 0.0 109.517 -179.644 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -76.87 -39.4 0.65 Allowed 'Trans proline' 0 C--N 1.306 -1.689 0 C-N-CA 122.821 2.347 . . . . 0.0 112.233 179.389 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.406 ' C ' HD22 ' A' ' 13' ' ' LEU . . . -66.17 -36.39 82.98 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.211 -0.931 . . . . 0.0 109.554 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.702 HD22 ' N ' ' A' ' 13' ' ' LEU . 3.4 mm? -88.23 156.91 51.26 Favored Pre-proline 0 N--CA 1.49 1.555 0 O-C-N 121.17 -0.956 . . . . 0.0 109.452 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -52.2 142.79 44.61 Favored 'Trans proline' 0 C--N 1.306 -1.692 0 C-N-CA 122.802 2.334 . . . . 0.0 112.154 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 98.5 mm-40 -47.09 131.96 12.36 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.189 -0.944 . . . . 0.0 109.465 -179.832 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 120.61 -21.65 8.47 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 179.847 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' TRP . . . . . 0.413 ' CH2' HD11 ' A' ' 55' ' ' LEU . 18.1 m95 -84.47 147.89 26.84 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.133 -1.216 . . . . 0.0 109.473 179.688 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.448 ' C ' ' SG ' ' A' ' 10' ' ' CYS . 94.1 mt-10 -127.51 148.14 50.32 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.274 -0.891 . . . . 0.0 109.42 -178.679 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.657 ' HE ' ' HE1' ' A' ' 8' ' ' TRP . 52.0 ttp180 -130.83 126.22 35.69 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.249 -0.907 . . . . 0.0 109.474 179.51 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -129.63 139.03 51.53 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.227 -0.921 . . . . 0.0 109.499 -179.537 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.532 ' H ' ' HB2' ' A' ' 6' ' ' LYS . 77.9 tt0 -101.51 145.63 28.74 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.325 -0.859 . . . . 0.0 109.362 179.06 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.5 t -142.56 121.82 7.74 Favored Pre-proline 0 N--CA 1.49 1.572 0 O-C-N 121.115 -0.991 . . . . 0.0 109.54 -179.159 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -78.73 144.57 19.59 Favored 'Trans proline' 0 C--N 1.305 -1.755 0 C-N-CA 122.797 2.331 . . . . 0.0 112.161 178.879 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.81 ' H ' ' NE ' ' A' ' 24' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.564 0 O-C-N 121.181 -0.949 . . . . 0.0 109.489 179.563 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' HIS . . . . . 0.595 ' O ' ' NE ' ' A' ' 24' ' ' ARG . 75.7 m80 . . . . . 0 N--CA 1.491 1.58 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 7.4 mtp180 -112.08 118.82 36.46 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.218 -0.927 . . . . 0.0 109.492 179.554 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -91.96 139.49 30.6 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.235 -0.916 . . . . 0.0 109.394 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.6 t -106.7 123.03 61.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.271 -0.893 . . . . 0.0 109.405 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -107.36 140.61 40.02 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.208 -0.933 . . . . 0.0 109.47 179.571 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.544 ' CD1' ' CE1' ' A' ' 66' ' ' PHE . 71.9 m-85 -109.4 142.25 40.62 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.251 -0.906 . . . . 0.0 109.471 -179.216 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 80.2 m-85 -126.39 139.29 53.39 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.242 -0.911 . . . . 0.0 109.496 -179.742 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.405 ' CB ' ' HD2' ' A' ' 40' ' ' PRO . 0.4 OUTLIER -99.7 165.22 15.07 Favored Pre-proline 0 N--CA 1.49 1.568 0 O-C-N 121.362 -0.836 . . . . 0.0 109.443 179.53 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.405 ' HD2' ' CB ' ' A' ' 39' ' ' SER . 20.5 Cg_endo -60.47 -19.1 57.59 Favored 'Trans proline' 0 C--N 1.305 -1.747 0 C-N-CA 122.805 2.337 . . . . 0.0 112.201 179.833 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 56.7 p -88.52 0.04 56.73 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.361 -0.837 . . . . 0.0 109.511 179.411 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 85.6 13.11 70.91 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -78.21 117.66 19.7 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.204 -1.174 . . . . 0.0 109.479 -179.773 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.75 ' HZ3' HH11 ' A' ' 46' ' ' ARG . 62.8 tttm -92.81 128.37 38.64 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.295 -0.878 . . . . 0.0 109.402 178.689 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.635 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 1.1 p90 -140.24 146.8 39.12 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.202 -0.936 . . . . 0.0 109.479 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.75 HH11 ' HZ3' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -141.7 59.78 1.49 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.218 -0.926 . . . . 0.0 109.525 179.008 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.1 t -157.73 144.97 18.29 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.231 -0.918 . . . . 0.0 109.568 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.603 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 3.8 tttt -68.5 -46.06 36.23 Favored Pre-proline 0 N--CA 1.49 1.575 0 O-C-N 121.176 -0.953 . . . . 0.0 109.437 -179.355 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.603 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 45.6 Cg_exo -55.77 -46.72 29.59 Favored 'Trans proline' 0 C--N 1.306 -1.695 0 C-N-CA 122.77 2.314 . . . . 0.0 112.23 -179.689 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -67.16 -39.94 86.57 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.208 -0.933 . . . . 0.0 109.447 179.794 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 57.0 tp -64.87 -45.81 84.44 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.252 -0.905 . . . . 0.0 109.497 -179.476 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.691 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -69.98 -45.3 67.63 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.271 -0.893 . . . . 0.0 109.474 -179.288 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 77.5 ttt-85 -60.18 -43.52 95.78 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.2 -0.938 . . . . 0.0 109.545 -179.697 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 37.5 t80 -62.43 -55.61 26.06 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.293 -0.879 . . . . 0.0 109.518 -179.114 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.488 ' CD1' HD12 ' A' ' 13' ' ' LEU . 96.4 mt -90.34 4.92 49.4 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.202 -0.936 . . . . 0.0 109.532 179.885 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLY . . . . . 0.691 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -48.6 -77.37 0.12 Allowed Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 -179.643 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.09 7.47 0.2 Allowed Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 -179.605 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.577 ' H ' ' C ' ' A' ' 56' ' ' GLY . 3.6 p -108.77 -26.85 10.09 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.209 -1.171 . . . . 0.0 109.498 -179.61 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.629 ' SD ' HD21 ' A' ' 61' ' ' LEU . 18.1 ptm -176.2 170.13 2.68 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.192 -0.942 . . . . 0.0 109.431 -179.843 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.518 ' O ' ' OD1' ' A' ' 60' ' ' ASP . 45.3 p-10 -97.24 116.47 29.51 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.317 -0.865 . . . . 0.0 109.452 179.655 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.629 HD21 ' SD ' ' A' ' 59' ' ' MET . 88.5 mt -111.8 16.45 20.45 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.352 -0.843 . . . . 0.0 109.463 -179.414 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 41.0 t -58.77 -39.28 80.57 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.284 -0.885 . . . . 0.0 109.436 -179.855 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 51.7 p -92.03 23.98 3.48 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.357 -0.84 . . . . 0.0 109.413 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 46.5 t80 -99.72 125.71 45.65 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.248 -0.907 . . . . 0.0 109.476 -179.729 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.437 ' OD2' ' OG1' ' A' ' 68' ' ' THR . 55.3 t0 -83.63 119.31 24.6 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.261 -0.899 . . . . 0.0 109.418 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.544 ' CE1' ' CD1' ' A' ' 37' ' ' TYR . 73.8 t80 -83.02 -33.23 26.55 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.235 -0.916 . . . . 0.0 109.541 -179.541 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 42.3 ttm180 -66.18 -43.94 85.43 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.264 -0.897 . . . . 0.0 109.529 -179.214 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' THR . . . . . 0.631 ' O ' ' NH1' ' A' ' 19' ' ' ARG . 11.3 p -96.47 -15.91 21.45 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.278 -0.889 . . . . 0.0 109.503 -179.867 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' GLY . . . . . 0.52 ' HA3' HH11 ' A' ' 19' ' ' ARG . . . 64.52 60.45 7.02 Favored Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.497 -1.441 . . . . 0.0 109.497 179.375 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -152.96 149.74 28.52 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.318 -1.107 . . . . 0.0 109.423 179.599 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 34.6 ttm -91.63 121.41 33.27 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.208 -0.932 . . . . 0.0 109.522 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.54 HD23 ' C ' ' A' ' 72' ' ' LEU . 3.4 tt . . . . . 0 N--CA 1.491 1.598 0 O-C-N 121.278 -0.889 . . . . 0.0 109.458 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.7 ptp180 . . . . . 0 N--CA 1.49 1.549 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.585 ' NZ ' ' O ' ' A' ' 21' ' ' GLU . 0.3 OUTLIER -120.68 123.35 42.53 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.294 -0.879 . . . . 0.0 109.526 179.948 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 83.7 mtp180 -100.66 108.44 20.32 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.246 -0.909 . . . . 0.0 109.501 -179.306 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 15.2 m0 -104.37 169.71 8.32 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.212 -0.93 . . . . 0.0 109.472 178.868 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -88.83 146.04 25.21 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.212 -0.93 . . . . 0.0 109.408 -179.661 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 17.8 t -121.34 100.73 44.67 Favored Pre-proline 0 N--CA 1.489 1.484 0 O-C-N 121.247 -0.908 . . . . 0.0 109.499 179.881 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -53.11 -40.18 77.7 Favored 'Trans proline' 0 C--N 1.304 -1.776 0 C-N-CA 122.864 2.376 . . . . 0.0 112.23 -179.816 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.42 -28.95 60.9 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.262 -0.899 . . . . 0.0 109.52 -179.725 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 14.5 mt -91.67 151.38 42.31 Favored Pre-proline 0 N--CA 1.49 1.53 0 O-C-N 121.302 -0.874 . . . . 0.0 109.436 -179.757 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -51.1 154.6 7.34 Favored 'Trans proline' 0 C--N 1.306 -1.709 0 C-N-CA 122.746 2.297 . . . . 0.0 112.256 179.029 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 89.5 mt-30 -58.25 121.02 9.73 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.254 -0.904 . . . . 0.0 109.477 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 124.52 -36.19 2.97 Favored Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 -179.766 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' TRP . . . . . 0.432 ' CZ2' HD11 ' A' ' 55' ' ' LEU . 37.5 m95 -74.61 149.02 40.22 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.219 -1.165 . . . . 0.0 109.453 178.967 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -139.46 153.35 47.53 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.139 -0.976 . . . . 0.0 109.489 -178.437 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.552 ' NH1' ' O ' ' A' ' 68' ' ' THR . 60.8 ttp180 -106.56 156.44 18.58 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.179 -0.951 . . . . 0.0 109.423 178.544 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.408 ' N ' ' HG2' ' A' ' 19' ' ' ARG . 39.2 tt0 -142.53 140.53 31.84 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.226 -0.921 . . . . 0.0 109.557 -178.572 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.585 ' O ' ' NZ ' ' A' ' 6' ' ' LYS . 81.2 mm-40 -113.92 121.04 42.74 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.187 -0.945 . . . . 0.0 109.407 178.004 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 39.2 t -128.79 133.78 25.58 Favored Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.215 -0.928 . . . . 0.0 109.609 -178.671 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -76.47 171.45 18.04 Favored 'Trans proline' 0 C--N 1.306 -1.703 0 C-N-CA 122.825 2.35 . . . . 0.0 112.221 178.21 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.548 ' NE ' ' OD2' ' A' ' 34' ' ' ASP . 12.7 mmt85 . . . . . 0 N--CA 1.49 1.56 0 O-C-N 121.333 -0.854 . . . . 0.0 109.366 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 36.2 m80 . . . . . 0 N--CA 1.489 1.515 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 19.1 ptp180 -128.94 150.75 50.25 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.212 -0.93 . . . . 0.0 109.493 -179.491 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.548 ' OD2' ' NE ' ' A' ' 24' ' ' ARG . 69.5 m-20 -129.68 146.24 51.47 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.264 -0.897 . . . . 0.0 109.454 179.497 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.473 HG22 ' OE1' ' A' ' 21' ' ' GLU . 33.3 t -105.06 132.4 51.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.225 -0.922 . . . . 0.0 109.446 -179.258 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 81.3 m-85 -122.75 152.45 40.61 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.161 -0.962 . . . . 0.0 109.505 179.137 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 68.0 m-85 -123.87 149.29 45.97 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.193 -0.942 . . . . 0.0 109.49 -179.703 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 53.5 m-85 -116.08 128.19 55.48 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.263 -0.898 . . . . 0.0 109.643 -179.397 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.535 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.5 OUTLIER -92.61 -177.94 0.8 Allowed Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.299 -0.876 . . . . 0.0 109.444 179.195 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.535 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 51.2 Cg_exo -55.37 -31.44 77.36 Favored 'Trans proline' 0 C--N 1.305 -1.746 0 C-N-CA 122.885 2.39 . . . . 0.0 112.248 -179.544 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.452 ' O ' ' OG ' ' A' ' 41' ' ' SER . 0.1 OUTLIER -93.05 11.81 26.28 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.184 -0.947 . . . . 0.0 109.528 179.019 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 73.66 14.85 79.54 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 -179.855 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 5.6 ttmt -64.36 128.73 37.05 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.175 -1.191 . . . . 0.0 109.44 -179.504 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 9.8 mtpm? -94.45 118.09 31.12 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.282 -0.886 . . . . 0.0 109.455 178.685 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 55.0 p90 -139.4 146.21 39.89 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.284 -0.885 . . . . 0.0 109.44 -179.638 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 26.6 ptt180 -126.32 57.78 1.39 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.336 -0.852 . . . . 0.0 109.493 179.345 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.5 t -150.45 130.33 13.33 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.236 -0.915 . . . . 0.0 109.504 179.779 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.852 ' N ' ' HD2' ' A' ' 49' ' ' PRO . 7.6 tmtt? -63.48 -46.81 84.17 Favored Pre-proline 0 N--CA 1.49 1.533 0 O-C-N 121.222 -0.924 . . . . 0.0 109.503 -179.915 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.852 ' HD2' ' N ' ' A' ' 48' ' ' LYS . 18.3 Cg_endo -57.95 -37.08 97.43 Favored 'Trans proline' 0 C--N 1.305 -1.734 0 C-N-CA 122.812 2.341 . . . . 0.0 112.235 178.971 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -67.66 -38.28 83.57 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.207 -0.933 . . . . 0.0 109.478 179.277 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.698 ' O ' HD23 ' A' ' 51' ' ' LEU . 2.0 tt -63.64 -42.32 98.14 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.26 -0.9 . . . . 0.0 109.505 -179.817 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.89 -39.75 90.94 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.28 -0.888 . . . . 0.0 109.491 -179.551 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 13.6 tpp180 -55.9 -45.98 78.48 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.254 -0.904 . . . . 0.0 109.521 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -62.59 -47.87 81.9 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.24 -0.913 . . . . 0.0 109.484 179.537 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.432 HD11 ' CZ2' ' A' ' 17' ' ' TRP . 8.1 mp -65.26 -0.59 1.84 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.291 -0.88 . . . . 0.0 109.437 179.504 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLY . . . . . 0.551 ' O ' ' C ' ' A' ' 57' ' ' GLY . . . 56.37 60.36 9.09 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.616 -1.394 . . . . 0.0 109.616 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' GLY . . . . . 0.551 ' C ' ' O ' ' A' ' 56' ' ' GLY . . . 34.34 38.41 0.11 Allowed Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 -179.351 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.468 ' N ' ' O ' ' A' ' 56' ' ' GLY . 89.0 p -88.95 -0.89 57.79 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.294 -1.121 . . . . 0.0 109.436 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.499 ' CE ' HD21 ' A' ' 61' ' ' LEU . 33.1 ttp -155.46 148.74 24.82 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.224 -0.922 . . . . 0.0 109.548 -179.736 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 55.1 t0 -85.76 101.81 13.11 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.232 -0.917 . . . . 0.0 109.482 -179.585 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.499 HD21 ' CE ' ' A' ' 59' ' ' MET . 89.1 mt -96.41 1.18 51.47 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.258 -0.901 . . . . 0.0 109.449 179.56 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 58.6 m -54.93 -27.19 41.49 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.143 -0.973 . . . . 0.0 109.458 179.585 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 36.1 p -94.11 1.46 56.13 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.27 -0.894 . . . . 0.0 109.547 179.563 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.435 ' CZ ' ' HA2' ' A' ' 69' ' ' GLY . 72.9 t80 -87.87 114.52 24.56 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.247 -0.908 . . . . 0.0 109.512 179.459 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -76.23 136.81 39.69 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.268 -0.895 . . . . 0.0 109.465 -179.498 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 69.4 t80 -89.15 -37.34 15.13 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.144 -0.972 . . . . 0.0 109.44 179.446 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 29.0 tpt85 -59.35 -44.44 92.67 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.278 -0.889 . . . . 0.0 109.461 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' THR . . . . . 0.552 ' O ' ' NH1' ' A' ' 19' ' ' ARG . 33.1 p -97.54 -20.53 17.65 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.324 -0.86 . . . . 0.0 109.485 179.659 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' GLY . . . . . 0.457 ' HA3' HH11 ' A' ' 19' ' ' ARG . . . 67.21 31.46 77.47 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.56 -1.416 . . . . 0.0 109.56 179.667 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.407 ' HZ2' HH12 ' A' ' 19' ' ' ARG . 64.6 mttp -132.11 152.58 51.15 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.232 -1.157 . . . . 0.0 109.525 -179.655 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 17.4 mtt -78.73 144.53 35.16 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.211 -0.931 . . . . 0.0 109.466 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.661 HD23 ' C ' ' A' ' 72' ' ' LEU . 5.1 tt . . . . . 0 N--CA 1.49 1.564 0 O-C-N 121.213 -0.929 . . . . 0.0 109.413 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.584 ' NH2' ' OE2' ' A' ' 20' ' ' GLU . 50.0 mtp180 . . . . . 0 N--CA 1.489 1.516 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.425 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 10.9 mptt -74.68 158.29 33.84 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.304 -0.872 . . . . 0.0 109.452 -179.0 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 79.8 mtp180 -150.92 140.26 21.37 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.246 -0.909 . . . . 0.0 109.456 -179.171 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.589 ' CD1' ' N ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -167.75 140.88 3.31 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.228 -0.92 . . . . 0.0 109.389 179.213 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -87.68 136.13 33.08 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.168 -0.957 . . . . 0.0 109.465 178.586 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 32.8 m -94.03 141.05 23.16 Favored Pre-proline 0 N--CA 1.489 1.511 0 O-C-N 121.149 -0.969 . . . . 0.0 109.505 -179.701 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -70.27 -14.81 34.89 Favored 'Trans proline' 0 C--N 1.304 -1.773 0 C-N-CA 122.893 2.396 . . . . 0.0 112.249 179.713 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.4 ' HB2' ' SD ' ' A' ' 71' ' ' MET . . . -90.78 -11.71 38.64 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.206 -0.934 . . . . 0.0 109.483 179.835 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 7.7 mp -99.71 148.95 35.46 Favored Pre-proline 0 N--CA 1.49 1.553 0 O-C-N 121.183 -0.948 . . . . 0.0 109.456 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' PRO . . . . . 0.408 ' HG2' ' CD1' ' A' ' 17' ' ' TRP . 47.2 Cg_endo -70.21 148.88 63.15 Favored 'Trans proline' 0 C--N 1.305 -1.738 0 C-N-CA 122.858 2.372 . . . . 0.0 112.213 178.983 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -52.97 129.31 30.12 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.313 -0.867 . . . . 0.0 109.52 -179.463 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 122.84 -25.09 6.56 Favored Glycine 0 N--CA 1.489 2.211 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 179.465 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' TRP . . . . . 0.434 ' CD1' ' N ' ' A' ' 17' ' ' TRP . 14.1 m95 -86.76 152.11 22.8 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.226 -1.161 . . . . 0.0 109.479 179.652 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -129.48 147.13 51.26 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.165 -0.96 . . . . 0.0 109.545 -179.422 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.553 ' NH1' ' NE1' ' A' ' 8' ' ' TRP . 75.0 ttt-85 -128.23 125.74 39.55 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.231 -0.918 . . . . 0.0 109.432 179.581 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.588 ' OE2' ' CE1' ' A' ' 38' ' ' TYR . 21.8 pt-20 -134.1 139.34 45.87 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.201 -0.937 . . . . 0.0 109.461 -179.553 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -101.55 151.3 22.14 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.278 -0.888 . . . . 0.0 109.4 -179.778 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.1 t -136.14 122.52 13.99 Favored Pre-proline 0 N--CA 1.491 1.578 0 O-C-N 121.226 -0.921 . . . . 0.0 109.518 -179.533 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' PRO . . . . . 0.414 ' CB ' ' NH1' ' A' ' 33' ' ' ARG . 62.0 Cg_endo -77.01 140.14 19.88 Favored 'Trans proline' 0 C--N 1.306 -1.689 0 C-N-CA 122.814 2.342 . . . . 0.0 112.109 -178.766 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 38.5 ttm180 . . . . . 0 N--CA 1.491 1.585 0 O-C-N 121.157 -0.964 . . . . 0.0 109.522 178.5 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 32' ' ' HIS . . . . . 0.676 ' C ' ' HE ' ' A' ' 33' ' ' ARG . 58.4 m80 . . . . . 0 N--CA 1.492 1.639 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.676 ' HE ' ' C ' ' A' ' 32' ' ' HIS . 0.4 OUTLIER -107.49 107.82 18.85 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.252 -0.905 . . . . 0.0 109.481 -179.261 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.511 ' OD1' ' N ' ' A' ' 35' ' ' VAL . 58.4 t0 -77.8 134.94 37.91 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.303 -0.873 . . . . 0.0 109.505 179.41 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.511 ' N ' ' OD1' ' A' ' 34' ' ' ASP . 47.1 t -105.45 128.13 59.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.247 -0.908 . . . . 0.0 109.47 -179.796 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.418 ' CZ ' ' OD2' ' A' ' 34' ' ' ASP . 72.7 m-85 -115.14 142.89 46.05 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.172 -0.955 . . . . 0.0 109.427 179.251 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.409 ' HB2' ' CE2' ' A' ' 45' ' ' PHE . 52.8 m-85 -111.22 142.73 43.03 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.273 -0.892 . . . . 0.0 109.462 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.588 ' CE1' ' OE2' ' A' ' 20' ' ' GLU . 19.9 m-85 -118.14 135.85 53.97 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.251 -0.905 . . . . 0.0 109.445 179.793 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.438 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -94.26 176.88 2.13 Favored Pre-proline 0 N--CA 1.49 1.551 0 O-C-N 121.231 -0.918 . . . . 0.0 109.474 179.55 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.438 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 42.1 Cg_exo -55.47 -29.88 71.07 Favored 'Trans proline' 0 C--N 1.304 -1.795 0 C-N-CA 122.897 2.398 . . . . 0.0 112.243 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 66.8 m -91.05 -2.29 57.67 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.176 -0.952 . . . . 0.0 109.548 -179.396 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 88.32 22.1 42.27 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.556 -1.418 . . . . 0.0 109.556 179.748 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 46.9 tttp -75.06 129.13 37.08 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.273 -1.133 . . . . 0.0 109.421 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 47.5 mtpt -94.27 120.87 35.14 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.263 -0.898 . . . . 0.0 109.531 179.301 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.599 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 2.0 p90 -141.68 150.63 42.13 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.197 -0.939 . . . . 0.0 109.389 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 10.6 ptm180 -143.04 68.94 1.3 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.331 -0.855 . . . . 0.0 109.453 179.194 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -148.1 129.45 14.77 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.179 -0.951 . . . . 0.0 109.439 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.639 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -61.2 -42.95 88.52 Favored Pre-proline 0 N--CA 1.488 1.448 0 O-C-N 121.209 -0.932 . . . . 0.0 109.461 -179.33 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.639 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 32.0 Cg_exo -58.2 -40.26 77.93 Favored 'Trans proline' 0 C--N 1.305 -1.752 0 C-N-CA 122.845 2.363 . . . . 0.0 112.242 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -65.79 -38.86 90.15 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.29 -0.881 . . . . 0.0 109.516 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.443 HD11 ' CE2' ' A' ' 45' ' ' PHE . 8.9 mp -65.29 -45.53 84.04 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.223 -0.923 . . . . 0.0 109.46 -179.667 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.667 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -72.35 -48.08 44.64 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.337 -0.852 . . . . 0.0 109.515 -179.379 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 80.1 mtp180 -58.9 -32.52 69.59 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.203 -0.936 . . . . 0.0 109.473 -179.413 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 24.2 t80 -86.01 -55.08 4.11 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.301 -0.875 . . . . 0.0 109.446 -178.55 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.404 ' O ' ' C ' ' A' ' 56' ' ' GLY . 95.2 mt -93.85 6.2 49.18 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.263 -0.898 . . . . 0.0 109.411 -178.217 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLY . . . . . 0.667 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -45.55 -72.29 0.39 Allowed Glycine 0 N--CA 1.492 2.374 0 N-CA-C 109.475 -1.45 . . . . 0.0 109.475 -179.599 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -57.41 -43.7 93.82 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 -179.016 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 54.1 p -58.2 -34.64 70.59 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.243 -1.151 . . . . 0.0 109.44 -179.344 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.404 ' N ' ' O ' ' A' ' 55' ' ' LEU . 1.7 mmm -170.53 162.82 8.23 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.33 -0.856 . . . . 0.0 109.472 -179.61 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 56.2 t0 -95.42 114.69 26.48 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.238 -0.914 . . . . 0.0 109.499 179.885 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 97.0 mt -106.67 3.13 26.43 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.277 -0.89 . . . . 0.0 109.501 -179.073 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 78.7 p -52.75 -36.76 58.36 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.263 -0.898 . . . . 0.0 109.408 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 54.3 p -81.17 14.45 2.34 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.273 -0.892 . . . . 0.0 109.457 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.625 ' O ' ' NZ ' ' A' ' 48' ' ' LYS . 47.0 t80 -88.75 133.15 34.33 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.255 -0.903 . . . . 0.0 109.402 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.499 ' O ' ' N ' ' A' ' 69' ' ' GLY . 64.4 t0 -82.87 114.11 20.95 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.299 -0.876 . . . . 0.0 109.48 -179.734 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 64.0 t80 -75.02 -44.89 45.4 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.249 -0.907 . . . . 0.0 109.477 -179.068 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.61 -46.09 84.52 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.314 -0.866 . . . . 0.0 109.459 -179.214 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' THR . . . . . 0.534 ' O ' ' NH2' ' A' ' 19' ' ' ARG . 43.3 p -94.71 -13.45 25.74 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.245 -0.91 . . . . 0.0 109.486 -179.836 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' GLY . . . . . 0.507 ' HA3' ' HE ' ' A' ' 19' ' ' ARG . . . 61.72 40.23 98.5 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 179.732 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -137.75 157.21 46.92 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.267 -1.137 . . . . 0.0 109.468 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.4 ' SD ' ' HB2' ' A' ' 12' ' ' ALA . 3.0 ttt -84.6 122.97 29.8 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.197 -0.939 . . . . 0.0 109.422 -179.684 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 7.2 tt . . . . . 0 N--CA 1.49 1.572 0 O-C-N 121.334 -0.854 . . . . 0.0 109.449 -179.908 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.448 ' N ' ' OE2' ' A' ' 20' ' ' GLU . 8.3 tpm_? . . . . . 0 N--CA 1.49 1.558 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.412 ' N ' ' HG3' ' A' ' 5' ' ' ARG . 7.4 ptmt -115.98 109.81 18.08 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.196 -0.94 . . . . 0.0 109.496 179.465 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -120.88 133.61 55.3 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.22 -0.925 . . . . 0.0 109.493 -179.424 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.444 ' HB2' ' HE ' ' A' ' 19' ' ' ARG . 2.0 m0 -129.82 175.97 8.41 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.232 -0.918 . . . . 0.0 109.502 179.879 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 -75.38 143.39 42.81 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.258 -0.902 . . . . 0.0 109.417 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.2 t -101.93 108.5 56.65 Favored Pre-proline 0 N--CA 1.49 1.575 0 O-C-N 121.259 -0.901 . . . . 0.0 109.448 179.703 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -77.01 -14.99 16.69 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 C-N-CA 122.891 2.394 . . . . 0.0 112.226 -179.223 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -71.39 -40.33 70.62 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.274 -0.891 . . . . 0.0 109.402 -179.746 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.524 ' N ' HD23 ' A' ' 13' ' ' LEU . 0.3 OUTLIER -96.19 -179.59 0.95 Allowed Pre-proline 0 N--CA 1.49 1.527 0 O-C-N 121.236 -0.915 . . . . 0.0 109.433 -179.947 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 14' ' ' PRO . . . . . 0.517 ' CD ' ' CB ' ' A' ' 13' ' ' LEU . 33.6 Cg_exo -60.34 145.91 97.67 Favored 'Trans proline' 0 C--N 1.306 -1.701 0 C-N-CA 122.786 2.324 . . . . 0.0 112.247 -179.481 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 19.2 mm100 -51.79 128.85 24.94 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.175 -0.953 . . . . 0.0 109.524 -179.821 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 123.96 -24.17 6.41 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.626 -1.39 . . . . 0.0 109.626 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 31.0 m95 -84.16 145.91 28.13 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.28 -1.129 . . . . 0.0 109.483 179.308 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -138.42 154.93 48.89 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.228 -0.92 . . . . 0.0 109.527 -179.458 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.598 ' CD ' ' H ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -126.59 162.17 26.32 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.294 -0.879 . . . . 0.0 109.474 179.252 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.448 ' OE2' ' N ' ' A' ' 5' ' ' ARG . 78.0 tt0 -143.22 144.55 32.2 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.219 -0.925 . . . . 0.0 109.48 -179.004 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -113.07 132.68 55.32 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.192 -0.942 . . . . 0.0 109.387 179.467 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.5 t -127.53 108.95 20.89 Favored Pre-proline 0 N--CA 1.491 1.589 0 O-C-N 121.217 -0.927 . . . . 0.0 109.609 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -74.53 142.72 29.84 Favored 'Trans proline' 0 C--N 1.305 -1.713 0 C-N-CA 122.811 2.341 . . . . 0.0 112.127 -178.557 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 80.6 mtp85 . . . . . 0 N--CA 1.489 1.512 0 O-C-N 121.189 -0.944 . . . . 0.0 109.448 179.059 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 78.5 m80 . . . . . 0 N--CA 1.489 1.512 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 36.2 ptt-85 -112.26 132.77 54.76 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.203 -0.935 . . . . 0.0 109.56 -179.738 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -87.88 142.24 27.96 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.266 -0.896 . . . . 0.0 109.475 179.289 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 59.6 t -112.72 125.74 70.02 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.317 -0.865 . . . . 0.0 109.496 179.91 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 84.0 m-85 -112.98 144.28 42.83 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.238 -0.913 . . . . 0.0 109.518 179.11 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.668 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 49.9 m-85 -112.71 148.46 34.66 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.233 -0.917 . . . . 0.0 109.455 -179.786 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.569 ' CD1' ' N ' ' A' ' 38' ' ' TYR . 3.1 m-85 -127.88 140.37 52.06 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.312 -0.867 . . . . 0.0 109.609 -179.934 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.431 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -96.21 176.64 2.07 Favored Pre-proline 0 N--CA 1.491 1.606 0 O-C-N 121.214 -0.929 . . . . 0.0 109.467 179.775 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.431 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 53.1 Cg_exo -54.29 -30.13 60.86 Favored 'Trans proline' 0 C--N 1.305 -1.728 0 C-N-CA 122.797 2.332 . . . . 0.0 112.252 179.568 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 11.7 t -88.0 -3.27 58.93 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.248 -0.908 . . . . 0.0 109.477 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 87.61 21.97 45.39 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.549 -1.421 . . . . 0.0 109.549 -179.673 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 61.6 tttp -73.57 123.76 24.59 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.306 -1.114 . . . . 0.0 109.452 -179.668 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -90.8 121.59 32.8 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.267 -0.895 . . . . 0.0 109.443 179.331 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.447 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 8.9 p90 -141.07 148.17 39.75 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.21 -0.931 . . . . 0.0 109.511 179.763 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -142.31 70.61 1.33 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.207 -0.933 . . . . 0.0 109.49 179.137 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.432 ' O ' HD23 ' A' ' 51' ' ' LEU . 1.5 p -158.67 144.44 16.68 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.296 -0.877 . . . . 0.0 109.423 179.575 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.675 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 12.9 tptt -65.46 -41.71 52.19 Favored Pre-proline 0 N--CA 1.49 1.547 0 O-C-N 121.316 -0.865 . . . . 0.0 109.455 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.675 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 39.0 Cg_exo -57.23 -40.35 83.22 Favored 'Trans proline' 0 C--N 1.306 -1.699 0 C-N-CA 122.839 2.36 . . . . 0.0 112.259 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -68.22 -39.1 82.45 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.202 -0.936 . . . . 0.0 109.46 179.747 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.432 HD23 ' O ' ' A' ' 47' ' ' SER . 4.0 mm? -61.92 -46.34 89.79 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.253 -0.904 . . . . 0.0 109.457 -179.504 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.633 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -73.9 -42.81 60.11 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.339 -0.851 . . . . 0.0 109.452 -179.361 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 75.7 ttt180 -58.59 -47.32 84.72 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.296 -0.877 . . . . 0.0 109.515 -179.912 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 18.4 t80 -69.8 -53.88 16.19 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.222 -0.924 . . . . 0.0 109.479 -179.454 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.438 ' O ' ' N ' ' A' ' 57' ' ' GLY . 96.0 mt -80.35 0.39 33.27 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.288 -0.883 . . . . 0.0 109.45 -179.142 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLY . . . . . 0.633 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -56.98 89.72 0.01 OUTLIER Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' GLY . . . . . 0.438 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . 133.18 -1.08 4.49 Favored Glycine 0 N--CA 1.491 2.346 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 -179.885 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 32.2 t -105.23 -31.02 9.3 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.27 -1.135 . . . . 0.0 109.457 179.786 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 3.1 ptp -178.71 176.75 0.94 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.33 -0.856 . . . . 0.0 109.512 -179.831 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -85.86 104.64 15.71 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.214 -0.929 . . . . 0.0 109.436 179.462 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -85.98 -0.89 56.62 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.162 -0.961 . . . . 0.0 109.453 -179.662 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 40.9 t -53.67 -37.64 63.38 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.157 -0.964 . . . . 0.0 109.442 -179.811 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' THR . . . . . 0.51 ' O ' ' SD ' ' A' ' 71' ' ' MET . 37.8 p -95.23 45.68 1.1 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.207 -0.933 . . . . 0.0 109.43 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 26.3 t80 -121.26 129.86 53.37 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.259 -0.901 . . . . 0.0 109.478 -179.69 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.454 ' O ' ' N ' ' A' ' 69' ' ' GLY . 57.9 t0 -90.2 110.17 21.22 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.266 -0.897 . . . . 0.0 109.418 -179.974 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.668 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 74.6 t80 -77.19 -40.27 45.86 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.233 -0.917 . . . . 0.0 109.445 -179.915 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 26.6 mmt180 -61.07 -39.31 89.4 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.23 -0.919 . . . . 0.0 109.53 -179.609 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' THR . . . . . 0.443 ' OG1' ' CG ' ' A' ' 65' ' ' ASP . 34.6 p -100.35 -15.45 17.98 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.27 -0.894 . . . . 0.0 109.516 -179.528 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' GLY . . . . . 0.454 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 64.21 42.64 97.84 Favored Glycine 0 N--CA 1.491 2.336 0 N-CA-C 109.542 -1.423 . . . . 0.0 109.542 179.661 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.5 tppt? -135.9 143.46 45.01 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.24 -1.153 . . . . 0.0 109.468 179.83 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.51 ' SD ' ' O ' ' A' ' 63' ' ' THR . 35.8 tpp -85.23 131.72 34.38 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.244 -0.91 . . . . 0.0 109.5 -179.616 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.566 HD23 ' C ' ' A' ' 72' ' ' LEU . 4.4 tt . . . . . 0 N--CA 1.491 1.588 0 O-C-N 121.177 -0.952 . . . . 0.0 109.442 -179.761 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 62.9 ttp180 . . . . . 0 N--CA 1.49 1.538 0 CA-C-O 121.324 0.583 . . . . 0.0 109.43 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 56.7 mttt -74.12 163.27 28.07 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.202 -0.936 . . . . 0.0 109.481 179.882 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.589 ' O ' ' CD1' ' A' ' 8' ' ' TRP . 15.0 mmt180 -142.38 134.03 26.78 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.248 -0.907 . . . . 0.0 109.499 -178.617 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.589 ' CD1' ' O ' ' A' ' 7' ' ' ARG . 5.8 m0 -159.62 132.81 6.95 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.147 -0.97 . . . . 0.0 109.477 179.831 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -73.62 148.55 42.76 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.251 -0.906 . . . . 0.0 109.465 179.286 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.433 ' SG ' HD13 ' A' ' 13' ' ' LEU . 34.1 t -112.69 100.99 52.11 Favored Pre-proline 0 N--CA 1.488 1.448 0 O-C-N 121.236 -0.915 . . . . 0.0 109.523 -179.585 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_exo -54.2 -29.14 55.18 Favored 'Trans proline' 0 C--N 1.306 -1.705 0 C-N-CA 122.885 2.39 . . . . 0.0 112.204 179.092 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.591 ' HB2' ' HG3' ' A' ' 71' ' ' MET . . . -66.25 -24.53 66.6 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.334 -0.854 . . . . 0.0 109.502 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.571 ' CD1' ' N ' ' A' ' 13' ' ' LEU . 4.8 mp -96.1 155.84 37.76 Favored Pre-proline 0 N--CA 1.489 1.519 0 O-C-N 121.263 -0.898 . . . . 0.0 109.542 -179.841 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' PRO . . . . . 0.675 ' HG3' HD11 ' A' ' 55' ' ' LEU . 37.7 Cg_exo -59.34 143.8 99.61 Favored 'Trans proline' 0 C--N 1.305 -1.719 0 C-N-CA 122.799 2.333 . . . . 0.0 112.182 179.273 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 70.5 tp60 -47.81 129.44 14.2 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.278 -0.889 . . . . 0.0 109.491 179.601 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 119.24 -21.9 9.16 Favored Glycine 0 N--CA 1.489 2.214 0 N-CA-C 109.576 -1.409 . . . . 0.0 109.576 -179.317 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' TRP . . . . . 0.41 ' N ' ' CD1' ' A' ' 17' ' ' TRP . 15.9 m95 -83.73 151.35 25.28 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.219 -1.165 . . . . 0.0 109.456 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -128.94 146.05 51.06 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.239 -0.913 . . . . 0.0 109.472 -179.394 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.533 ' NH2' HG11 ' A' ' 35' ' ' VAL . 77.8 ttt-85 -127.86 123.87 36.12 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.242 -0.911 . . . . 0.0 109.478 178.853 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.543 ' OE1' ' CZ ' ' A' ' 7' ' ' ARG . 7.2 pt-20 -131.37 138.92 49.35 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.254 -0.903 . . . . 0.0 109.529 -179.834 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 46.0 tt0 -94.39 143.95 25.97 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.333 -0.854 . . . . 0.0 109.423 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.411 HG13 ' HD2' ' A' ' 23' ' ' PRO . 47.3 t -126.5 135.56 27.41 Favored Pre-proline 0 N--CA 1.49 1.552 0 O-C-N 121.206 -0.933 . . . . 0.0 109.606 -179.257 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' PRO . . . . . 0.411 ' HD2' HG13 ' A' ' 22' ' ' VAL . 34.9 Cg_endo -65.58 152.21 82.47 Favored 'Trans proline' 0 C--N 1.304 -1.772 0 C-N-CA 122.828 2.352 . . . . 0.0 112.214 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.511 ' CZ ' ' O ' ' A' ' 24' ' ' ARG . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.589 0 O-C-N 121.258 -0.901 . . . . 0.0 109.504 -178.992 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 74.0 m80 . . . . . 0 N--CA 1.49 1.552 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 84.8 mtt85 -111.62 128.05 55.93 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.228 -0.92 . . . . 0.0 109.461 179.818 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 97.1 m-20 -91.37 140.28 29.92 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.135 -0.978 . . . . 0.0 109.461 -179.575 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.533 HG11 ' NH2' ' A' ' 19' ' ' ARG . 21.5 t -106.08 132.85 52.13 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.272 -0.893 . . . . 0.0 109.436 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.526 ' CD1' ' NZ ' ' A' ' 44' ' ' LYS . 78.4 m-85 -120.96 142.23 49.94 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.299 -0.876 . . . . 0.0 109.444 179.634 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -112.31 146.36 38.39 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.299 -0.876 . . . . 0.0 109.536 -179.642 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 87.7 m-85 -126.49 139.98 52.81 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.176 -0.953 . . . . 0.0 109.529 179.668 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.412 ' CB ' ' HD2' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -100.44 165.18 14.87 Favored Pre-proline 0 N--CA 1.489 1.502 0 O-C-N 121.223 -0.923 . . . . 0.0 109.418 179.644 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.412 ' HD2' ' CB ' ' A' ' 39' ' ' SER . 18.8 Cg_endo -58.81 -19.37 46.43 Favored 'Trans proline' 0 C--N 1.306 -1.685 0 C-N-CA 122.783 2.322 . . . . 0.0 112.258 179.705 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 3.0 p -89.98 -0.91 57.84 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.291 -0.88 . . . . 0.0 109.433 179.725 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 86.61 14.65 65.17 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.506 -1.438 . . . . 0.0 109.506 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -80.35 117.42 21.09 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.296 -1.12 . . . . 0.0 109.511 -179.633 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.526 ' NZ ' ' CD1' ' A' ' 36' ' ' PHE . 61.5 tttm -92.57 128.86 38.58 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.297 -0.877 . . . . 0.0 109.396 178.765 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.624 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 1.0 OUTLIER -139.71 147.25 40.66 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.222 -0.924 . . . . 0.0 109.457 -179.716 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.623 ' NE ' ' O ' ' A' ' 46' ' ' ARG . 0.6 OUTLIER -137.36 62.12 1.6 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.161 -0.962 . . . . 0.0 109.53 179.635 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -150.14 133.34 16.31 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.306 -0.871 . . . . 0.0 109.433 179.871 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.599 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 1.1 tmtp? -55.42 -46.79 99.65 Favored Pre-proline 0 N--CA 1.491 1.59 0 O-C-N 121.238 -0.913 . . . . 0.0 109.437 -179.599 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.599 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 51.8 Cg_exo -53.7 -35.28 77.56 Favored 'Trans proline' 0 C--N 1.306 -1.685 0 C-N-CA 122.813 2.342 . . . . 0.0 112.234 -179.799 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.581 ' OE1' ' NH2' ' A' ' 53' ' ' ARG . 3.6 mm100 -67.09 -36.85 82.86 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.246 -0.909 . . . . 0.0 109.554 179.821 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.475 ' CD2' ' N ' ' A' ' 51' ' ' LEU . 3.8 mm? -66.4 -53.9 30.56 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.153 -0.967 . . . . 0.0 109.457 -179.046 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.617 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -66.97 -47.7 70.77 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.331 -0.855 . . . . 0.0 109.511 -178.521 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.581 ' NH2' ' OE1' ' A' ' 50' ' ' GLN . 57.3 ttp180 -59.21 -45.06 92.11 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.278 -0.889 . . . . 0.0 109.463 -178.839 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -69.7 -54.48 13.6 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.334 -0.854 . . . . 0.0 109.468 -179.211 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.675 HD11 ' HG3' ' A' ' 14' ' ' PRO . 1.8 mm? -80.42 -0.58 37.74 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.271 -0.893 . . . . 0.0 109.487 -179.462 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLY . . . . . 0.919 ' O ' ' N ' ' A' ' 58' ' ' SER . . . -51.39 -176.13 0.03 OUTLIER Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.514 -1.434 . . . . 0.0 109.514 179.641 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 43.9 -69.81 0.0 OUTLIER Glycine 0 N--CA 1.491 2.337 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.919 ' N ' ' O ' ' A' ' 56' ' ' GLY . 82.8 p -57.72 -30.89 65.91 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.29 -1.123 . . . . 0.0 109.441 -178.244 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.443 ' O ' ' O ' ' A' ' 55' ' ' LEU . 1.3 mmm -167.29 160.19 13.33 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.209 -0.932 . . . . 0.0 109.493 -179.419 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 45.2 t0 -109.59 129.08 55.61 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.201 -0.937 . . . . 0.0 109.441 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 94.4 mt -114.65 16.12 17.55 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.193 -0.942 . . . . 0.0 109.427 -179.173 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 12.0 t -58.03 -38.04 75.48 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.257 -0.902 . . . . 0.0 109.462 179.825 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 17.9 p -87.9 19.62 3.46 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.266 -0.896 . . . . 0.0 109.5 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 60.0 t80 -88.52 132.38 34.53 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.213 -0.929 . . . . 0.0 109.458 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.51 ' HB2' HD23 ' A' ' 72' ' ' LEU . 60.1 t0 -83.43 111.51 19.1 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.356 -0.84 . . . . 0.0 109.454 -179.39 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 15.6 t80 -76.63 -39.93 50.85 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.256 -0.903 . . . . 0.0 109.517 -179.792 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.548 ' H ' ' NE ' ' A' ' 67' ' ' ARG . 0.2 OUTLIER -63.83 -42.29 97.65 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.182 -0.949 . . . . 0.0 109.575 -179.16 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 68' ' ' THR . . . . . 0.447 ' OG1' ' OD2' ' A' ' 65' ' ' ASP . 27.5 p -98.43 -12.47 21.34 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.317 -0.864 . . . . 0.0 109.591 -179.359 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' GLY . . . . . 0.445 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 63.21 39.87 98.41 Favored Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.526 -1.43 . . . . 0.0 109.526 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.479 ' H ' ' HB3' ' A' ' 65' ' ' ASP . 68.6 mttm -140.3 157.76 45.07 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.154 -1.204 . . . . 0.0 109.453 -179.523 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.591 ' HG3' ' HB2' ' A' ' 12' ' ' ALA . 68.4 mtp -86.02 132.21 34.1 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.257 -0.902 . . . . 0.0 109.556 179.805 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.51 HD23 ' HB2' ' A' ' 65' ' ' ASP . 4.0 mm? . . . . . 0 N--CA 1.491 1.612 0 O-C-N 121.301 -0.874 . . . . 0.0 109.472 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.6 mtt85 . . . . . 0 N--CA 1.49 1.571 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.425 ' HB2' ' CZ2' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -121.84 113.64 19.93 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.318 -0.863 . . . . 0.0 109.441 -179.86 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.492 ' C ' ' CD ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -102.86 123.17 46.0 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.22 -0.925 . . . . 0.0 109.462 179.849 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.425 ' CZ2' ' HB2' ' A' ' 6' ' ' LYS . 7.7 m0 -125.76 175.21 7.78 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.284 -0.885 . . . . 0.0 109.458 179.844 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 31.2 tp10 -81.15 155.12 26.37 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.271 -0.893 . . . . 0.0 109.526 179.686 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.554 ' SG ' ' N ' ' A' ' 19' ' ' ARG . 3.4 m -114.3 100.51 52.95 Favored Pre-proline 0 N--CA 1.49 1.562 0 O-C-N 121.29 -0.881 . . . . 0.0 109.395 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -53.64 -38.04 84.01 Favored 'Trans proline' 0 C--N 1.305 -1.727 0 C-N-CA 122.879 2.386 . . . . 0.0 112.255 179.437 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.0 -39.5 78.43 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.225 -0.922 . . . . 0.0 109.529 -179.522 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.574 ' CD2' ' N ' ' A' ' 13' ' ' LEU . 2.5 mm? -91.63 155.78 43.53 Favored Pre-proline 0 N--CA 1.489 1.499 0 O-C-N 121.2 -0.937 . . . . 0.0 109.546 179.896 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -55.59 160.27 9.62 Favored 'Trans proline' 0 C--N 1.303 -1.819 0 C-N-CA 122.905 2.403 . . . . 0.0 112.228 -179.591 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 59.3 tt0 -54.63 125.32 19.34 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.206 -0.934 . . . . 0.0 109.466 -179.166 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 125.23 -20.99 6.54 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.601 -1.4 . . . . 0.0 109.601 179.259 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' TRP . . . . . 0.401 ' CG ' ' HB3' ' A' ' 13' ' ' LEU . 34.9 m95 -89.59 140.9 29.09 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.196 -1.179 . . . . 0.0 109.488 178.875 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.577 ' N ' ' OE1' ' A' ' 18' ' ' GLU . 54.5 mp0 -135.8 152.8 51.46 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.269 -0.895 . . . . 0.0 109.508 -179.09 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.554 ' N ' ' SG ' ' A' ' 10' ' ' CYS . 4.8 ptm85 -118.52 161.24 20.35 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.269 -0.894 . . . . 0.0 109.428 178.82 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.564 ' O ' HG13 ' A' ' 35' ' ' VAL . 79.1 tt0 -143.05 137.43 29.22 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.208 -0.932 . . . . 0.0 109.5 -179.351 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.427 ' HG2' HG22 ' A' ' 35' ' ' VAL . 99.2 mt-10 -110.91 131.0 55.42 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.241 -0.912 . . . . 0.0 109.334 -179.803 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.9 t -136.1 123.27 14.5 Favored Pre-proline 0 N--CA 1.49 1.528 0 O-C-N 121.165 -0.959 . . . . 0.0 109.549 -179.838 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -75.76 135.51 17.8 Favored 'Trans proline' 0 C--N 1.304 -1.791 0 C-N-CA 122.816 2.344 . . . . 0.0 112.209 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 35.8 ttm180 . . . . . 0 N--CA 1.491 1.585 0 O-C-N 121.237 -0.914 . . . . 0.0 109.429 179.962 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 19.1 m170 . . . . . 0 N--CA 1.49 1.562 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 62.4 ttp180 -114.14 126.19 54.8 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.28 -0.888 . . . . 0.0 109.419 -179.642 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.505 ' OD1' ' O ' ' A' ' 34' ' ' ASP . 3.5 p30 -107.25 141.46 38.52 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.224 -0.923 . . . . 0.0 109.403 -179.827 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.564 HG13 ' O ' ' A' ' 20' ' ' GLU . 35.1 t -114.89 131.91 65.68 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.143 -0.973 . . . . 0.0 109.426 -179.817 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -106.57 148.32 28.4 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.287 -0.883 . . . . 0.0 109.409 179.497 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.574 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 63.4 m-85 -116.1 147.18 41.58 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.302 -0.874 . . . . 0.0 109.439 -179.396 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -129.39 143.03 50.68 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.228 -0.92 . . . . 0.0 109.491 -179.446 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.429 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -97.88 176.57 1.98 Allowed Pre-proline 0 N--CA 1.491 1.575 0 O-C-N 121.347 -0.846 . . . . 0.0 109.428 179.784 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.429 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 48.6 Cg_exo -54.46 -28.53 54.83 Favored 'Trans proline' 0 C--N 1.305 -1.74 0 C-N-CA 122.888 2.392 . . . . 0.0 112.227 179.632 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 95.0 p -89.67 0.68 56.8 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.241 -0.912 . . . . 0.0 109.475 179.781 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 83.91 17.75 64.77 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 -179.681 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 61.0 tttp -70.5 122.58 19.95 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.25 -1.147 . . . . 0.0 109.479 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 63.7 tttm -92.39 125.83 37.22 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.222 -0.924 . . . . 0.0 109.531 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.591 ' HE2' HD21 ' A' ' 51' ' ' LEU . 3.3 p90 -140.32 146.99 39.2 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.225 -0.922 . . . . 0.0 109.466 -179.693 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 46' ' ' ARG . 6.3 ptm85 -139.31 59.28 1.61 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.359 -0.838 . . . . 0.0 109.433 179.138 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.3 m -152.38 131.84 12.96 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.188 -0.945 . . . . 0.0 109.52 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.614 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 3.2 tmtp? -61.2 -45.39 95.54 Favored Pre-proline 0 N--CA 1.489 1.505 0 O-C-N 121.221 -0.924 . . . . 0.0 109.413 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.614 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 42.7 Cg_exo -55.69 -43.39 58.04 Favored 'Trans proline' 0 C--N 1.305 -1.747 0 C-N-CA 122.807 2.338 . . . . 0.0 112.224 179.58 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -65.02 -36.46 84.46 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.229 -0.919 . . . . 0.0 109.542 179.408 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.591 HD21 ' HE2' ' A' ' 45' ' ' PHE . 15.1 mt -62.11 -44.29 96.97 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.32 -0.863 . . . . 0.0 109.491 -179.829 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.708 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -77.2 -46.61 22.71 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.223 -0.923 . . . . 0.0 109.502 -179.865 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 14.1 tpp180 -54.15 -26.57 28.42 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.152 -0.967 . . . . 0.0 109.505 -179.519 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 68.1 t80 -97.59 -53.39 3.45 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.295 -0.878 . . . . 0.0 109.519 -179.485 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.424 ' C ' ' H ' ' A' ' 57' ' ' GLY . 3.4 tp -106.93 -4.6 18.94 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.197 -0.939 . . . . 0.0 109.497 -178.005 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' GLY . . . . . 0.708 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -61.61 -2.38 3.32 Favored Glycine 0 N--CA 1.489 2.213 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 -179.789 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' GLY . . . . . 0.424 ' H ' ' C ' ' A' ' 55' ' ' LEU . . . -99.17 -52.18 1.27 Allowed Glycine 0 N--CA 1.491 2.318 0 N-CA-C 109.526 -1.429 . . . . 0.0 109.526 -179.842 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 9.3 m -77.86 -10.43 59.56 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.265 -1.138 . . . . 0.0 109.524 179.905 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 52.1 ttm -159.19 152.07 21.94 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.222 -0.924 . . . . 0.0 109.483 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.477 ' OD1' ' OG ' ' A' ' 62' ' ' SER . 59.6 t0 -91.27 110.82 22.12 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.253 -0.904 . . . . 0.0 109.476 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.567 HD22 ' N ' ' A' ' 61' ' ' LEU . 3.8 mm? -93.72 -1.07 55.62 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.334 -0.854 . . . . 0.0 109.445 -179.929 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.477 ' OG ' ' OD1' ' A' ' 60' ' ' ASP . 94.1 p -57.63 -37.47 73.37 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.265 -0.897 . . . . 0.0 109.55 179.609 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 48.3 p -91.75 10.15 29.59 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.196 -0.94 . . . . 0.0 109.549 -179.941 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -87.51 132.7 33.94 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.204 -0.935 . . . . 0.0 109.487 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.478 ' CG ' ' OG1' ' A' ' 68' ' ' THR . 55.3 t0 -85.49 110.81 19.45 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.298 -0.876 . . . . 0.0 109.543 -179.835 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.574 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 81.7 t80 -77.2 -41.32 41.85 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.269 -0.895 . . . . 0.0 109.482 -179.402 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 16.5 tpp180 -63.19 -42.53 99.35 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.265 -0.897 . . . . 0.0 109.501 -179.177 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' THR . . . . . 0.478 ' OG1' ' CG ' ' A' ' 65' ' ' ASP . 25.5 p -96.22 -13.4 23.48 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.297 -0.877 . . . . 0.0 109.473 -179.529 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' GLY . . . . . 0.409 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 62.54 41.87 99.75 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.415 -1.474 . . . . 0.0 109.415 179.731 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.436 ' H ' ' HB3' ' A' ' 65' ' ' ASP . 98.5 mttt -134.54 147.87 50.39 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.222 -1.164 . . . . 0.0 109.43 -179.717 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 34.2 ttm -89.86 125.17 35.23 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.217 -0.927 . . . . 0.0 109.561 -179.888 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 2.3 pp . . . . . 0 N--CA 1.489 1.52 0 O-C-N 121.223 -0.923 . . . . 0.0 109.519 179.833 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.443 ' HB3' HG22 ' A' ' 22' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.533 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.621 ' NZ ' ' O ' ' A' ' 21' ' ' GLU . 0.3 OUTLIER -115.61 110.39 19.13 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.207 -0.933 . . . . 0.0 109.493 179.864 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 86.3 mtm180 -93.5 112.37 24.26 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.365 -0.834 . . . . 0.0 109.483 -179.819 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 11.9 m0 -105.26 160.16 15.32 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.267 -0.896 . . . . 0.0 109.376 179.355 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -77.2 139.4 39.88 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.179 -0.95 . . . . 0.0 109.455 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.541 ' SG ' HD23 ' A' ' 13' ' ' LEU . 2.4 t -106.12 102.49 40.09 Favored Pre-proline 0 N--CA 1.49 1.528 0 O-C-N 121.269 -0.894 . . . . 0.0 109.548 179.309 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -72.48 -13.26 27.6 Favored 'Trans proline' 0 C--N 1.304 -1.764 0 C-N-CA 122.838 2.359 . . . . 0.0 112.265 -178.521 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.572 ' C ' HD22 ' A' ' 13' ' ' LEU . . . -82.65 -20.11 36.91 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.181 -0.949 . . . . 0.0 109.494 -179.682 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.673 HD22 ' N ' ' A' ' 13' ' ' LEU . 3.8 mm? -101.13 157.93 32.74 Favored Pre-proline 0 N--CA 1.49 1.55 0 O-C-N 121.222 -0.924 . . . . 0.0 109.465 -179.873 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -52.69 144.67 41.99 Favored 'Trans proline' 0 C--N 1.305 -1.742 0 C-N-CA 122.804 2.336 . . . . 0.0 112.188 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -47.19 123.33 5.33 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.281 -0.887 . . . . 0.0 109.445 -179.524 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 124.02 -21.77 6.9 Favored Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.647 -1.381 . . . . 0.0 109.647 179.67 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' TRP . . . . . 0.406 ' CZ3' ' CZ ' ' A' ' 45' ' ' PHE . 21.3 m95 -85.42 146.68 26.86 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.225 -1.162 . . . . 0.0 109.439 179.505 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -132.13 149.32 52.43 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.194 -0.941 . . . . 0.0 109.451 -179.554 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.547 ' HE ' HG11 ' A' ' 35' ' ' VAL . 77.7 ttt-85 -114.92 157.44 23.36 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.188 -0.945 . . . . 0.0 109.497 179.416 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.673 ' OE1' HG23 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -152.5 153.68 33.97 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.248 -0.908 . . . . 0.0 109.494 -179.092 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.621 ' O ' ' NZ ' ' A' ' 6' ' ' LYS . 79.2 tt0 -119.5 131.28 55.54 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.331 -0.856 . . . . 0.0 109.338 179.318 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.673 HG23 ' OE1' ' A' ' 20' ' ' GLU . 7.6 t -130.28 125.35 21.75 Favored Pre-proline 0 N--CA 1.489 1.517 0 O-C-N 121.218 -0.926 . . . . 0.0 109.6 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -73.76 122.63 7.91 Favored 'Trans proline' 0 C--N 1.304 -1.81 0 C-N-CA 122.804 2.336 . . . . 0.0 112.156 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.595 0 O-C-N 121.199 -0.938 . . . . 0.0 109.473 -179.716 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 13.4 m170 . . . . . 0 N--CA 1.49 1.566 0 N-CA-C 109.406 -0.591 . . . . 0.0 109.406 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 38.2 mmm-85 -112.27 109.07 18.52 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.254 -0.904 . . . . 0.0 109.508 -179.395 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -94.22 141.13 28.91 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.193 -0.942 . . . . 0.0 109.39 179.827 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.547 HG11 ' HE ' ' A' ' 19' ' ' ARG . 49.0 t -107.32 132.11 55.65 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.282 -0.887 . . . . 0.0 109.4 -179.152 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 -122.4 145.88 47.86 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.208 -0.933 . . . . 0.0 109.469 178.598 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.672 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 63.6 m-85 -119.02 151.52 38.07 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.311 -0.868 . . . . 0.0 109.382 -179.275 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 47.3 m-85 -123.7 139.9 53.53 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.187 -0.946 . . . . 0.0 109.518 179.638 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.451 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -95.37 177.28 1.85 Allowed Pre-proline 0 N--CA 1.49 1.561 0 O-C-N 121.33 -0.856 . . . . 0.0 109.539 179.178 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.451 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 48.3 Cg_exo -54.33 -29.21 56.9 Favored 'Trans proline' 0 C--N 1.304 -1.763 0 C-N-CA 122.838 2.359 . . . . 0.0 112.116 179.92 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 20.9 t -90.46 -1.55 57.9 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.251 -0.906 . . . . 0.0 109.499 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 86.46 22.51 47.12 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 75.5 tttt -75.42 127.17 32.52 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.193 -1.181 . . . . 0.0 109.453 -179.721 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.443 ' O ' ' HG3' ' A' ' 44' ' ' LYS . 21.3 ptmt -93.0 124.79 37.22 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.247 -0.908 . . . . 0.0 109.477 179.382 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.592 ' CE2' HD11 ' A' ' 51' ' ' LEU . 3.6 p90 -141.87 150.53 41.69 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.207 -0.933 . . . . 0.0 109.439 179.803 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.553 ' CD ' ' N ' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -135.66 67.02 1.49 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.262 -0.899 . . . . 0.0 109.472 179.708 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.3 m -157.15 116.87 3.43 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.304 -0.873 . . . . 0.0 109.403 179.551 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.584 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -53.78 -46.84 98.25 Favored Pre-proline 0 N--CA 1.489 1.52 0 O-C-N 121.256 -0.902 . . . . 0.0 109.542 -178.933 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.584 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 52.2 Cg_exo -54.35 -39.13 88.51 Favored 'Trans proline' 0 C--N 1.305 -1.717 0 C-N-CA 122.805 2.336 . . . . 0.0 112.202 179.433 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -61.54 -36.3 80.19 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.297 -0.877 . . . . 0.0 109.448 179.369 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.592 HD11 ' CE2' ' A' ' 45' ' ' PHE . 11.2 mp -66.46 -42.58 87.35 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.255 -0.903 . . . . 0.0 109.437 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -66.89 -50.41 62.54 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.174 -0.954 . . . . 0.0 109.471 -179.563 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.463 HH12 ' HB3' ' A' ' 49' ' ' PRO . 96.1 mtm-85 -60.18 -44.88 94.71 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.209 -0.932 . . . . 0.0 109.542 -179.378 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 67.8 t80 -65.81 -55.21 18.31 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.201 -0.937 . . . . 0.0 109.466 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 96.5 mt -61.45 -42.01 98.1 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.21 -0.931 . . . . 0.0 109.504 -179.849 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 93.94 -146.53 18.18 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 109.561 -1.416 . . . . 0.0 109.561 179.689 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -98.16 27.38 19.54 Favored Glycine 0 N--CA 1.492 2.381 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 179.761 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 13.0 m -89.42 -25.8 21.33 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.261 -1.141 . . . . 0.0 109.485 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 97.5 mtp -143.45 134.29 25.33 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.273 -0.892 . . . . 0.0 109.412 179.669 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -97.94 116.39 30.05 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.284 -0.885 . . . . 0.0 109.461 179.274 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.433 HD23 ' HA ' ' A' ' 61' ' ' LEU . 97.1 mt -95.82 2.75 53.95 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.119 -0.988 . . . . 0.0 109.469 -179.556 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 69.0 m -50.76 -39.01 51.2 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.255 -0.903 . . . . 0.0 109.506 179.644 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 31.4 p -94.6 39.67 1.09 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.254 -0.904 . . . . 0.0 109.52 179.229 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 85.0 t80 -125.75 125.67 43.35 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.257 -0.902 . . . . 0.0 109.437 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.603 ' O ' ' N ' ' A' ' 69' ' ' GLY . 89.3 m-20 -76.71 107.66 9.18 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.168 -0.958 . . . . 0.0 109.524 -179.609 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.672 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 54.5 t80 -74.78 -48.88 23.05 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.174 -0.953 . . . . 0.0 109.51 -179.821 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 18.3 mmm180 -54.72 -42.26 71.32 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.276 -0.89 . . . . 0.0 109.564 179.666 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 6.7 p -98.09 -14.35 20.51 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.169 -0.957 . . . . 0.0 109.462 -179.748 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' GLY . . . . . 0.603 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 64.77 31.68 81.7 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 179.728 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.417 ' H ' ' HB2' ' A' ' 65' ' ' ASP . 72.0 mmtt -112.57 150.66 31.03 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.227 -1.16 . . . . 0.0 109.436 -179.803 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 11.9 tpp -93.86 123.97 37.56 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.197 -0.939 . . . . 0.0 109.484 179.848 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.484 ' C ' HD13 ' A' ' 72' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.573 0 O-C-N 121.135 -0.978 . . . . 0.0 109.458 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 31.0 ptt180 . . . . . 0 N--CA 1.49 1.537 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.426 ' HB2' ' H ' ' A' ' 21' ' ' GLU . 2.5 mmtp -63.06 147.8 49.68 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.352 -0.843 . . . . 0.0 109.501 -179.291 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 73.6 ttp85 -149.97 138.93 21.02 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.234 -0.916 . . . . 0.0 109.472 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.57 ' CD1' ' N ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -167.33 142.2 3.9 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.22 -0.925 . . . . 0.0 109.463 -179.828 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -103.64 142.45 34.3 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.241 -0.912 . . . . 0.0 109.458 178.517 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.818 ' SG ' HD13 ' A' ' 13' ' ' LEU . 0.8 OUTLIER -115.19 129.15 25.32 Favored Pre-proline 0 N--CA 1.49 1.568 0 O-C-N 121.311 -0.868 . . . . 0.0 109.461 -179.657 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -51.16 -24.26 14.59 Favored 'Trans proline' 0 C--N 1.305 -1.715 0 C-N-CA 122.901 2.401 . . . . 0.0 112.233 178.499 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.466 ' O ' ' SD ' ' A' ' 59' ' ' MET . . . -71.08 -16.44 62.58 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.196 -0.94 . . . . 0.0 109.496 -179.602 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.818 HD13 ' SG ' ' A' ' 10' ' ' CYS . 5.5 mp -102.01 148.95 36.08 Favored Pre-proline 0 N--CA 1.49 1.565 0 O-C-N 121.192 -0.943 . . . . 0.0 109.402 -179.894 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' PRO . . . . . 0.465 ' HG2' ' CD1' ' A' ' 17' ' ' TRP . 37.3 Cg_endo -67.5 149.0 79.9 Favored 'Trans proline' 0 C--N 1.305 -1.726 0 C-N-CA 122.904 2.403 . . . . 0.0 112.17 179.876 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.618 ' O ' ' NE2' ' A' ' 15' ' ' GLN . 1.5 pm0 -54.44 125.98 21.65 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.294 -0.878 . . . . 0.0 109.506 -179.131 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 122.38 -29.12 5.58 Favored Glycine 0 N--CA 1.491 2.337 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 179.351 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' TRP . . . . . 0.603 ' CZ2' ' OG ' ' A' ' 39' ' ' SER . 17.0 m95 -89.23 155.42 19.41 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.213 -1.169 . . . . 0.0 109.452 179.363 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -149.63 164.54 34.89 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.142 -0.974 . . . . 0.0 109.429 -178.855 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.602 ' NH1' ' O ' ' A' ' 69' ' ' GLY . 13.0 mtm105 -132.69 131.99 41.89 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.245 -0.909 . . . . 0.0 109.476 178.772 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -136.48 141.54 43.49 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.175 -0.953 . . . . 0.0 109.562 -178.771 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.537 ' OE2' ' CZ ' ' A' ' 33' ' ' ARG . 80.4 tt0 -102.43 147.01 27.25 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.315 -0.866 . . . . 0.0 109.358 179.022 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.5 t -149.31 127.59 5.9 Favored Pre-proline 0 N--CA 1.49 1.535 0 O-C-N 121.184 -0.948 . . . . 0.0 109.65 -178.603 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -77.33 140.07 19.16 Favored 'Trans proline' 0 C--N 1.306 -1.707 0 C-N-CA 122.851 2.367 . . . . 0.0 112.167 178.629 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.573 ' NE ' ' OD1' ' A' ' 34' ' ' ASP . 99.2 mtt180 . . . . . 0 N--CA 1.49 1.527 0 O-C-N 121.186 -0.947 . . . . 0.0 109.534 179.526 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 . . . . . 0 N--CA 1.491 1.609 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.537 ' CZ ' ' OE2' ' A' ' 21' ' ' GLU . 83.7 mtp180 -120.25 136.72 54.56 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.256 -0.903 . . . . 0.0 109.415 -179.721 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.573 ' OD1' ' NE ' ' A' ' 24' ' ' ARG . 4.6 m-20 -122.74 143.5 49.78 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.239 -0.913 . . . . 0.0 109.419 -179.709 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 65.5 t -105.9 136.1 41.55 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 O-C-N 121.244 -0.91 . . . . 0.0 109.442 179.816 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -122.27 147.08 46.66 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.358 -0.838 . . . . 0.0 109.51 179.857 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.453 ' CB ' ' CE2' ' A' ' 45' ' ' PHE . 8.5 m-85 -112.71 139.32 48.42 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.251 -0.906 . . . . 0.0 109.455 -179.878 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 74.7 m-85 -114.33 128.44 56.35 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.221 -0.924 . . . . 0.0 109.575 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.603 ' OG ' ' CZ2' ' A' ' 17' ' ' TRP . 0.1 OUTLIER -97.61 177.28 1.69 Allowed Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.279 -0.888 . . . . 0.0 109.447 179.251 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.444 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 52.8 Cg_exo -53.76 -30.39 56.57 Favored 'Trans proline' 0 C--N 1.306 -1.677 0 C-N-CA 122.904 2.402 . . . . 0.0 112.24 179.402 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 96.4 p -87.52 4.97 41.42 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.317 -0.864 . . . . 0.0 109.461 179.56 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 74.9 12.86 82.94 Favored Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 179.755 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 5.4 ttmt -73.32 131.27 41.72 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.24 -1.153 . . . . 0.0 109.452 -179.862 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 16.9 pttp -94.7 130.05 41.36 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.247 -0.908 . . . . 0.0 109.447 179.195 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.668 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 0.7 OUTLIER -139.53 146.3 39.74 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.271 -0.893 . . . . 0.0 109.399 -179.918 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 46.0 ptt85 -139.88 53.07 1.68 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.367 -0.833 . . . . 0.0 109.506 -179.795 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.4 p -150.93 134.99 16.73 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.281 -0.887 . . . . 0.0 109.464 179.573 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.607 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 0.9 OUTLIER -58.42 -46.13 99.64 Favored Pre-proline 0 N--CA 1.49 1.563 0 O-C-N 121.216 -0.927 . . . . 0.0 109.461 179.887 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.607 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 52.2 Cg_exo -53.16 -43.23 58.92 Favored 'Trans proline' 0 C--N 1.305 -1.717 0 C-N-CA 122.836 2.357 . . . . 0.0 112.189 -179.655 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -68.19 -33.94 75.36 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.248 -0.907 . . . . 0.0 109.522 179.096 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.635 HD13 ' O ' ' A' ' 51' ' ' LEU . 0.3 OUTLIER -59.37 -49.68 76.88 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.246 -0.909 . . . . 0.0 109.488 179.65 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -71.77 -37.6 70.45 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.183 -0.948 . . . . 0.0 109.55 -179.566 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 42.3 ttm180 -56.22 -51.08 69.4 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.247 -0.908 . . . . 0.0 109.558 -179.336 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' TYR . . . . . 0.441 ' C ' ' H ' ' A' ' 56' ' ' GLY . 18.4 t80 -68.51 -50.03 55.17 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.368 -0.833 . . . . 0.0 109.503 -179.708 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.436 ' O ' ' OG ' ' A' ' 58' ' ' SER . 4.2 mm? -64.23 1.2 0.78 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.144 -0.972 . . . . 0.0 109.444 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' GLY . . . . . 0.548 ' O ' ' C ' ' A' ' 57' ' ' GLY . . . 51.91 64.0 4.31 Favored Glycine 0 N--CA 1.492 2.384 0 N-CA-C 109.46 -1.456 . . . . 0.0 109.46 179.794 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' GLY . . . . . 0.548 ' C ' ' O ' ' A' ' 56' ' ' GLY . . . 33.82 36.0 0.05 OUTLIER Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.556 -1.417 . . . . 0.0 109.556 -179.515 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.53 ' N ' ' O ' ' A' ' 56' ' ' GLY . 74.2 m -85.24 -0.58 55.1 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.21 -1.171 . . . . 0.0 109.486 179.746 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.466 ' SD ' ' O ' ' A' ' 12' ' ' ALA . 40.6 ttp -157.34 149.69 22.86 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.351 -0.843 . . . . 0.0 109.497 -179.869 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 91.1 m-20 -86.34 106.35 17.33 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.292 -0.88 . . . . 0.0 109.405 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.6 HD22 ' N ' ' A' ' 61' ' ' LEU . 3.7 mm? -89.61 -4.89 57.62 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.222 -0.924 . . . . 0.0 109.462 -179.933 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 37.9 m -58.49 -33.89 70.3 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.297 -0.877 . . . . 0.0 109.532 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 17.9 p -96.45 9.22 42.01 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.178 -0.951 . . . . 0.0 109.48 -179.82 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 89.7 t80 -90.24 135.12 33.87 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.225 -0.922 . . . . 0.0 109.419 179.807 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.515 ' O ' ' N ' ' A' ' 69' ' ' GLY . 9.8 m-20 -85.67 111.29 19.95 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.248 -0.908 . . . . 0.0 109.582 179.818 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 77.4 t80 -75.16 -47.64 27.45 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.211 -0.931 . . . . 0.0 109.392 -179.286 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.45 ' HA ' ' HE ' ' A' ' 67' ' ' ARG . 0.3 OUTLIER -56.4 -43.84 79.7 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.251 -0.906 . . . . 0.0 109.474 -179.351 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 30.0 p -94.51 -15.38 24.21 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.165 -0.959 . . . . 0.0 109.515 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' GLY . . . . . 0.602 ' O ' ' NH1' ' A' ' 19' ' ' ARG . . . 63.69 35.68 92.35 Favored Glycine 0 N--CA 1.49 2.239 0 N-CA-C 109.568 -1.413 . . . . 0.0 109.568 179.797 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 54.8 mtpt -125.61 151.35 46.6 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.329 -1.101 . . . . 0.0 109.529 -179.543 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 10.8 tpp -93.54 121.78 35.3 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.257 -0.902 . . . . 0.0 109.405 179.812 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 56.4 tp . . . . . 0 N--CA 1.49 1.559 0 O-C-N 121.179 -0.951 . . . . 0.0 109.416 179.876 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.528 4.789 0 N-CA-C 119.407 2.523 . . . . 0.0 119.407 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.491 ' O ' ' C ' ' A' ' 3' ' ' MET . 11.2 p -84.54 151.76 24.35 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.279 -1.13 . . . . 0.0 109.482 -179.738 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.491 ' C ' ' O ' ' A' ' 2' ' ' SER . 65.9 mtt 40.05 61.92 1.39 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.243 -0.911 . . . . 0.0 109.488 179.645 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 79.6 mt-10 -70.82 130.84 42.74 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.266 -0.896 . . . . 0.0 109.528 179.598 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 33.8 ptt180 -127.15 135.89 51.33 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.275 -0.891 . . . . 0.0 109.47 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 12.6 mttp -85.26 169.89 13.35 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.25 -0.907 . . . . 0.0 109.539 179.209 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.547 ' NH1' ' OE2' ' A' ' 20' ' ' GLU . 61.8 ttt85 -155.87 95.04 1.6 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.207 -0.933 . . . . 0.0 109.441 -178.942 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 7.7 m0 -111.24 139.41 46.64 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.247 -0.908 . . . . 0.0 109.475 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -83.43 149.67 26.53 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.276 -0.89 . . . . 0.0 109.467 179.605 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 34.3 m -114.75 100.46 53.39 Favored Pre-proline 0 N--CA 1.491 1.587 0 O-C-N 121.203 -0.935 . . . . 0.0 109.492 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -55.56 -27.21 58.75 Favored 'Trans proline' 0 C--N 1.305 -1.748 0 C-N-CA 122.877 2.385 . . . . 0.0 112.272 178.3 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.41 -34.48 74.01 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.257 -0.902 . . . . 0.0 109.474 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.413 ' N ' HD23 ' A' ' 13' ' ' LEU . 9.4 mt -90.15 157.46 45.37 Favored Pre-proline 0 N--CA 1.489 1.524 0 O-C-N 121.18 -0.95 . . . . 0.0 109.376 -179.812 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_exo -54.8 145.26 62.08 Favored 'Trans proline' 0 C--N 1.305 -1.723 0 C-N-CA 122.848 2.365 . . . . 0.0 112.185 179.664 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 94.4 mm-40 -49.57 127.85 16.38 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.323 -0.861 . . . . 0.0 109.463 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 123.88 -18.35 7.55 Favored Glycine 0 N--CA 1.49 2.24 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' TRP . . . . . 0.405 ' CD1' ' N ' ' A' ' 17' ' ' TRP . 21.1 m95 -93.0 150.74 20.33 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.259 -1.142 . . . . 0.0 109.468 179.14 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.509 ' N ' ' OE1' ' A' ' 18' ' ' GLU . 59.4 mp0 -144.42 160.91 40.28 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.227 -0.92 . . . . 0.0 109.463 -179.474 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.533 ' CZ ' HG11 ' A' ' 35' ' ' VAL . 33.6 ttt180 -121.2 156.88 31.45 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.221 -0.924 . . . . 0.0 109.42 179.286 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.547 ' OE2' ' NH1' ' A' ' 7' ' ' ARG . 95.9 mt-10 -147.23 142.59 27.39 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.221 -0.924 . . . . 0.0 109.524 -179.662 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 80.2 tt0 -115.18 133.85 55.67 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.277 -0.889 . . . . 0.0 109.456 179.58 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.6 t -129.09 123.29 21.67 Favored Pre-proline 0 N--CA 1.491 1.589 0 O-C-N 121.272 -0.893 . . . . 0.0 109.538 -178.847 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -77.04 129.86 10.85 Favored 'Trans proline' 0 C--N 1.306 -1.701 0 C-N-CA 122.868 2.379 . . . . 0.0 112.145 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 23.3 mmm180 -80.33 158.17 26.16 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.185 -0.947 . . . . 0.0 109.424 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 82.3 mtp180 -152.54 35.2 0.5 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.252 -0.905 . . . . 0.0 109.518 -179.415 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.489 ' O ' ' C ' ' A' ' 27' ' ' GLY . 58.0 m -103.68 105.84 16.18 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.296 -0.878 . . . . 0.0 109.453 -179.151 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.489 ' C ' ' O ' ' A' ' 26' ' ' SER . . . 38.51 -128.61 1.8 Allowed Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.48 -1.448 . . . . 0.0 109.48 179.039 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.526 ' C ' ' H ' ' A' ' 30' ' ' ALA . 97.0 mt -63.7 -27.79 69.45 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.254 -1.145 . . . . 0.0 109.443 -179.027 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.464 ' N ' ' O ' ' A' ' 26' ' ' SER . 0.5 OUTLIER -69.73 16.38 0.06 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.234 -0.916 . . . . 0.0 109.536 -179.636 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.526 ' H ' ' C ' ' A' ' 28' ' ' LEU . . . -90.62 163.73 14.45 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.3 -0.875 . . . . 0.0 109.431 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 82.19 -38.38 2.58 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.56 -1.416 . . . . 0.0 109.56 179.641 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 -61.27 138.75 58.23 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.225 -1.162 . . . . 0.0 109.453 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 84.7 mtm-85 -115.64 127.61 55.32 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.246 -0.909 . . . . 0.0 109.556 -179.727 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.451 ' OD1' ' N ' ' A' ' 35' ' ' VAL . 62.8 t0 -106.12 142.55 35.63 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.229 -0.919 . . . . 0.0 109.417 -179.902 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.533 HG11 ' CZ ' ' A' ' 19' ' ' ARG . 46.9 t -111.03 129.4 66.36 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.246 -0.909 . . . . 0.0 109.413 -179.592 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -116.69 145.37 43.49 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.255 -0.903 . . . . 0.0 109.514 179.118 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.627 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 60.2 m-85 -115.05 149.8 36.91 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.273 -0.892 . . . . 0.0 109.472 179.638 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 94.9 m-85 -127.76 140.39 52.09 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.246 -0.909 . . . . 0.0 109.518 179.397 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.47 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -97.91 178.35 1.36 Allowed Pre-proline 0 N--CA 1.489 1.509 0 O-C-N 121.242 -0.911 . . . . 0.0 109.504 179.452 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.47 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 35.6 Cg_exo -56.6 -29.31 78.66 Favored 'Trans proline' 0 C--N 1.305 -1.727 0 C-N-CA 122.826 2.351 . . . . 0.0 112.206 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 91.4 p -87.39 -0.92 57.5 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.164 -0.96 . . . . 0.0 109.485 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 83.53 22.2 56.71 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -74.8 126.06 30.12 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.262 -1.14 . . . . 0.0 109.454 179.655 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -94.33 121.55 35.97 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.275 -0.89 . . . . 0.0 109.542 179.447 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.636 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 1.2 p90 -141.36 149.83 41.65 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.214 -0.929 . . . . 0.0 109.506 -179.874 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.93 68.62 1.42 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.256 -0.903 . . . . 0.0 109.464 179.247 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 44.9 m -151.06 130.71 13.09 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.279 -0.888 . . . . 0.0 109.466 179.617 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.736 ' N ' ' HD2' ' A' ' 49' ' ' PRO . 20.3 tttt -60.73 -53.92 59.61 Favored Pre-proline 0 N--CA 1.49 1.54 0 O-C-N 121.288 -0.882 . . . . 0.0 109.457 -179.517 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.736 ' HD2' ' N ' ' A' ' 48' ' ' LYS . 10.9 Cg_endo -52.99 -38.53 80.02 Favored 'Trans proline' 0 C--N 1.304 -1.766 0 C-N-CA 122.853 2.369 . . . . 0.0 112.203 -179.521 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 92.9 mt-30 -64.66 -36.95 85.91 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.205 -0.934 . . . . 0.0 109.521 178.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 4.1 mt -64.75 -44.53 89.8 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.284 -0.885 . . . . 0.0 109.429 179.712 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.696 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -73.79 -45.57 50.78 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.213 -0.929 . . . . 0.0 109.485 -179.219 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -60.88 -44.52 96.97 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.265 -0.897 . . . . 0.0 109.489 -179.792 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 29.0 t80 -66.8 -54.17 25.38 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.312 -0.868 . . . . 0.0 109.492 -179.482 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 94.6 mt -91.84 10.58 28.02 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.224 -0.923 . . . . 0.0 109.479 -179.436 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.696 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -49.61 -71.08 0.66 Allowed Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 -179.63 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -54.07 -44.06 73.25 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 109.568 -1.413 . . . . 0.0 109.568 -179.427 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 95.8 p -59.36 -29.66 67.84 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.231 -1.158 . . . . 0.0 109.463 -179.666 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.661 ' SD ' HD21 ' A' ' 61' ' ' LEU . 0.0 OUTLIER 179.5 173.38 0.86 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.229 -0.919 . . . . 0.0 109.479 -179.856 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 90.6 m-20 -102.24 123.48 46.15 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.287 -0.883 . . . . 0.0 109.477 179.758 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.661 HD21 ' SD ' ' A' ' 59' ' ' MET . 98.6 mt -116.88 13.69 15.03 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.236 -0.915 . . . . 0.0 109.483 -179.586 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 92.9 p -56.11 -33.9 65.55 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.27 -0.894 . . . . 0.0 109.475 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 21.5 p -92.88 19.77 7.32 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.218 -0.926 . . . . 0.0 109.519 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -88.57 135.6 33.41 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.204 -0.935 . . . . 0.0 109.445 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.518 ' O ' ' N ' ' A' ' 69' ' ' GLY . 51.8 t0 -87.38 111.56 21.22 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.192 -0.943 . . . . 0.0 109.481 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.627 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 74.6 t80 -75.91 -41.68 51.15 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.227 -0.92 . . . . 0.0 109.527 -179.323 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.422 ' HD2' ' N ' ' A' ' 67' ' ' ARG . 3.2 mpt_? -62.12 -39.51 92.78 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.199 -0.938 . . . . 0.0 109.494 -179.046 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.458 ' OG1' ' CG ' ' A' ' 65' ' ' ASP . 44.0 p -103.05 -13.41 16.85 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.309 -0.869 . . . . 0.0 109.471 -178.447 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.518 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 62.79 42.37 99.69 Favored Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.476 ' H ' ' HB3' ' A' ' 65' ' ' ASP . 68.6 mttm -132.71 154.5 50.12 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.227 -1.161 . . . . 0.0 109.488 -179.775 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 57.0 ttm -91.61 125.13 36.23 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.291 -0.881 . . . . 0.0 109.514 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 8.6 tp . . . . . 0 N--CA 1.489 1.525 0 O-C-N 121.259 -0.901 . . . . 0.0 109.479 179.85 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.528 4.796 0 N-CA-C 119.461 2.544 . . . . 0.0 119.461 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 42.3 t -72.38 133.2 44.8 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.225 -1.162 . . . . 0.0 109.529 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 5.5 ttt -106.8 119.2 38.7 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.268 -0.895 . . . . 0.0 109.487 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -145.92 80.83 1.59 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.224 -0.923 . . . . 0.0 109.531 179.658 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 85.0 mtp180 -106.05 113.71 27.42 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.253 -0.905 . . . . 0.0 109.479 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.436 ' O ' ' HA ' ' A' ' 20' ' ' GLU . 0.5 OUTLIER -111.14 106.18 15.13 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.264 -0.897 . . . . 0.0 109.53 179.917 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 56.0 ttp180 -102.13 118.12 36.22 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.181 -0.95 . . . . 0.0 109.34 -179.466 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.559 ' CD1' ' N ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -124.99 144.56 50.32 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.221 -0.924 . . . . 0.0 109.429 179.603 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -57.43 141.27 47.97 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.207 -0.933 . . . . 0.0 109.443 -179.745 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.5 ' SG ' ' C ' ' A' ' 17' ' ' TRP . 0.8 OUTLIER -96.64 123.03 55.52 Favored Pre-proline 0 N--CA 1.491 1.588 0 O-C-N 121.254 -0.904 . . . . 0.0 109.51 179.72 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -73.75 -32.87 7.02 Favored 'Trans proline' 0 C--N 1.304 -1.771 0 C-N-CA 122.88 2.387 . . . . 0.0 112.249 -178.77 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.0 -38.02 85.26 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.337 -0.852 . . . . 0.0 109.516 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.578 ' CD1' ' N ' ' A' ' 13' ' ' LEU . 5.1 mp -84.01 156.59 63.8 Favored Pre-proline 0 N--CA 1.49 1.566 0 O-C-N 121.277 -0.889 . . . . 0.0 109.52 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -49.72 155.75 3.63 Favored 'Trans proline' 0 C--N 1.306 -1.699 0 C-N-CA 122.774 2.316 . . . . 0.0 112.284 179.6 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -56.29 123.73 15.61 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.19 -0.944 . . . . 0.0 109.468 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 123.26 -33.99 3.82 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 179.445 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' TRP . . . . . 0.5 ' C ' ' SG ' ' A' ' 10' ' ' CYS . 49.8 m95 -71.31 149.59 45.97 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.308 -1.113 . . . . 0.0 109.481 179.222 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 68.3 mt-10 -145.32 157.98 43.93 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.345 -0.847 . . . . 0.0 109.54 -178.644 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.426 ' NH1' ' O ' ' A' ' 68' ' ' THR . 21.1 ptt180 -141.59 145.62 35.28 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.3 -0.875 . . . . 0.0 109.432 179.046 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.436 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 19.2 pt-20 -130.39 143.3 50.68 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.226 -0.921 . . . . 0.0 109.584 -179.385 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -98.59 136.99 37.89 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.267 -0.896 . . . . 0.0 109.471 178.417 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 30.7 t -143.13 100.92 5.3 Favored Pre-proline 0 N--CA 1.49 1.575 0 O-C-N 121.23 -0.919 . . . . 0.0 109.529 -179.172 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_exo -56.69 136.51 76.58 Favored 'Trans proline' 0 C--N 1.305 -1.726 0 C-N-CA 122.872 2.382 . . . . 0.0 112.185 177.388 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 23.0 ptt180 -119.04 90.96 3.44 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.239 -0.913 . . . . 0.0 109.491 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 52.7 ptt85 -92.87 20.21 6.85 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.27 -0.894 . . . . 0.0 109.428 178.756 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 32.8 m -134.14 113.86 12.51 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.16 -0.962 . . . . 0.0 109.456 -179.198 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 155.64 -168.01 33.2 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.595 -1.402 . . . . 0.0 109.595 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.4 ' HA ' HD23 ' A' ' 28' ' ' LEU . 94.3 mt -79.88 -50.2 10.82 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.257 -1.143 . . . . 0.0 109.473 179.355 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.501 ' O ' ' O ' ' A' ' 30' ' ' ALA . 65.2 p -96.77 24.26 6.25 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.301 -0.875 . . . . 0.0 109.442 178.916 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.501 ' O ' ' O ' ' A' ' 29' ' ' SER . . . -44.03 170.39 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.245 -0.909 . . . . 0.0 109.487 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 110.03 -31.12 7.72 Favored Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.591 -1.404 . . . . 0.0 109.591 -179.763 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 28.9 m170 -96.96 174.79 6.59 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.226 -1.161 . . . . 0.0 109.468 -179.745 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 50.5 ptt85 -118.35 137.53 53.03 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.351 -0.843 . . . . 0.0 109.465 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.409 ' OD1' ' N ' ' A' ' 35' ' ' VAL . 64.0 t0 -104.16 133.92 48.27 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.26 -0.9 . . . . 0.0 109.438 -179.495 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.409 ' N ' ' OD1' ' A' ' 34' ' ' ASP . 57.7 t -109.68 132.91 56.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 O-C-N 121.26 -0.9 . . . . 0.0 109.442 179.379 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -111.72 141.81 44.87 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.233 -0.917 . . . . 0.0 109.388 -179.176 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.541 ' CE1' ' CZ ' ' A' ' 66' ' ' PHE . 44.1 m-85 -114.81 143.25 45.38 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.25 -0.907 . . . . 0.0 109.475 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 87.8 m-85 -122.91 133.34 54.41 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.182 -0.949 . . . . 0.0 109.513 -179.324 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.472 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.4 OUTLIER -98.59 178.59 1.26 Allowed Pre-proline 0 N--CA 1.491 1.576 0 O-C-N 121.262 -0.899 . . . . 0.0 109.486 179.58 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.472 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 48.7 Cg_exo -54.6 -29.92 62.99 Favored 'Trans proline' 0 C--N 1.305 -1.752 0 C-N-CA 122.853 2.369 . . . . 0.0 112.206 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 96.4 p -85.89 7.82 22.65 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.272 -0.892 . . . . 0.0 109.485 179.74 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 72.71 8.59 72.76 Favored Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 -179.76 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 3.8 tmmt? -67.49 128.99 38.49 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.298 -1.119 . . . . 0.0 109.492 -179.759 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 51.9 pttt -99.14 130.34 45.45 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.262 -0.899 . . . . 0.0 109.451 179.02 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.491 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 9.8 p90 -141.69 149.19 40.24 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.306 -0.872 . . . . 0.0 109.479 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 25.7 ptt-85 -130.84 50.69 2.2 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.176 -0.952 . . . . 0.0 109.486 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -159.27 143.87 15.45 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.226 -0.921 . . . . 0.0 109.478 -179.888 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.633 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 10.6 tttt -60.14 -44.67 96.99 Favored Pre-proline 0 N--CA 1.489 1.501 0 O-C-N 121.205 -0.934 . . . . 0.0 109.515 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.633 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 47.3 Cg_exo -55.99 -38.69 94.33 Favored 'Trans proline' 0 C--N 1.305 -1.741 0 C-N-CA 122.855 2.37 . . . . 0.0 112.192 179.706 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 94.9 mm-40 -67.57 -37.97 83.4 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.259 -0.901 . . . . 0.0 109.482 179.535 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.46 ' CD1' ' CZ3' ' A' ' 17' ' ' TRP . 57.8 tp -61.04 -45.58 94.19 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.307 -0.871 . . . . 0.0 109.509 179.747 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.517 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -68.59 -40.37 80.51 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.241 -0.912 . . . . 0.0 109.392 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 77.7 ttt-85 -53.5 -44.65 69.25 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.328 -0.857 . . . . 0.0 109.478 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 50.5 t80 -66.31 -49.2 67.86 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.242 -0.911 . . . . 0.0 109.423 179.365 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.583 ' O ' ' N ' ' A' ' 57' ' ' GLY . 98.6 mt -80.75 4.87 17.5 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.25 -0.906 . . . . 0.0 109.454 179.753 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.517 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . 60.11 -74.6 0.01 OUTLIER Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.561 -1.416 . . . . 0.0 109.561 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLY . . . . . 0.583 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . 177.28 37.66 0.06 OUTLIER Glycine 0 N--CA 1.49 2.241 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 -179.712 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 87.1 p -93.34 8.32 40.91 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.23 -1.159 . . . . 0.0 109.45 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 99.7 mtp -145.87 139.83 26.59 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.23 -0.918 . . . . 0.0 109.5 -179.75 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.404 ' OD1' ' N ' ' A' ' 60' ' ' ASP . 38.4 p-10 -80.53 96.02 6.67 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.103 -0.998 . . . . 0.0 109.494 179.572 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 90.1 mt -95.41 -1.83 50.19 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.286 -0.884 . . . . 0.0 109.48 -179.309 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 35.8 t -53.96 -29.83 44.37 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.182 -0.949 . . . . 0.0 109.505 179.741 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 69.4 p -106.91 18.49 21.75 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.302 -0.874 . . . . 0.0 109.527 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.437 ' O ' ' CE ' ' A' ' 48' ' ' LYS . 14.8 t80 -88.22 124.73 34.14 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.215 -0.928 . . . . 0.0 109.51 -179.746 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.415 ' O ' ' N ' ' A' ' 69' ' ' GLY . 7.8 m-20 -79.92 113.57 18.18 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.302 -0.874 . . . . 0.0 109.451 -179.535 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.541 ' CZ ' ' CE1' ' A' ' 37' ' ' TYR . 58.5 t80 -79.24 -42.21 26.45 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.293 -0.879 . . . . 0.0 109.442 -179.791 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 83.7 mmt-85 -62.86 -40.17 96.67 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.199 -0.938 . . . . 0.0 109.453 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.426 ' O ' ' NH1' ' A' ' 19' ' ' ARG . 27.6 p -97.78 -13.62 21.26 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.335 -0.853 . . . . 0.0 109.472 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.415 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 61.62 40.41 98.71 Favored Glycine 0 N--CA 1.489 2.204 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 -179.844 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -128.67 149.7 50.56 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.172 -1.193 . . . . 0.0 109.437 -179.627 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 36.6 ttm -94.12 112.86 24.71 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.267 -0.896 . . . . 0.0 109.397 179.702 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.437 HD22 ' HA ' ' A' ' 72' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.533 0 O-C-N 121.287 -0.883 . . . . 0.0 109.41 -179.88 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.529 4.897 0 N-CA-C 119.447 2.539 . . . . 0.0 119.447 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.2 m 48.1 90.34 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.157 -1.202 . . . . 0.0 109.467 -179.547 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 6.5 ptp -60.84 136.68 58.15 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.245 -0.909 . . . . 0.0 109.41 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -103.99 152.75 21.64 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.275 -0.891 . . . . 0.0 109.428 -179.767 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.4 tpt180 60.87 75.15 0.42 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.336 -0.852 . . . . 0.0 109.459 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 31.1 mttt -79.4 169.69 17.7 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.291 -0.88 . . . . 0.0 109.462 -179.64 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.574 ' O ' ' CD1' ' A' ' 8' ' ' TRP . 79.0 mtp85 -143.66 135.12 26.08 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.324 -0.86 . . . . 0.0 109.455 -178.701 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.574 ' CD1' ' O ' ' A' ' 7' ' ' ARG . 6.3 m0 -157.85 129.09 6.63 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.207 -0.933 . . . . 0.0 109.438 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 45.8 tt0 -86.9 121.58 29.58 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.149 -0.97 . . . . 0.0 109.556 178.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.467 ' CA ' HH12 ' A' ' 19' ' ' ARG . 0.0 OUTLIER -79.61 123.85 83.97 Favored Pre-proline 0 N--CA 1.49 1.532 0 O-C-N 121.316 -0.865 . . . . 0.0 109.479 -179.444 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -71.8 -13.53 29.46 Favored 'Trans proline' 0 C--N 1.305 -1.721 0 C-N-CA 122.797 2.331 . . . . 0.0 112.235 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.563 ' HB3' ' CE1' ' A' ' 64' ' ' PHE . . . -82.64 -14.72 54.22 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.279 -0.888 . . . . 0.0 109.531 179.76 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.618 HD21 HD11 ' A' ' 51' ' ' LEU . 5.8 mp -100.38 156.07 35.66 Favored Pre-proline 0 N--CA 1.49 1.571 0 O-C-N 121.161 -0.962 . . . . 0.0 109.428 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.577 ' CG ' HD11 ' A' ' 55' ' ' LEU . 31.5 Cg_exo -57.1 142.09 94.27 Favored 'Trans proline' 0 C--N 1.305 -1.741 0 C-N-CA 122.911 2.407 . . . . 0.0 112.202 178.791 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -47.77 128.82 13.6 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.323 -0.86 . . . . 0.0 109.411 179.741 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 117.83 -17.79 11.82 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 -179.617 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' TRP . . . . . 0.403 ' NE1' ' HD3' ' A' ' 40' ' ' PRO . 24.3 m95 -92.09 151.77 20.26 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.365 -1.079 . . . . 0.0 109.458 179.866 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -151.05 164.8 35.59 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.252 -0.905 . . . . 0.0 109.502 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.467 HH12 ' CA ' ' A' ' 10' ' ' CYS . 35.9 ptt-85 -142.7 149.13 38.41 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.29 -0.881 . . . . 0.0 109.509 179.331 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -124.51 162.94 22.93 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.26 -0.9 . . . . 0.0 109.509 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -117.54 135.66 53.79 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.302 -0.874 . . . . 0.0 109.388 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.4 t -131.32 115.2 16.15 Favored Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.261 -0.899 . . . . 0.0 109.546 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -76.58 142.02 22.81 Favored 'Trans proline' 0 C--N 1.304 -1.786 0 C-N-CA 122.91 2.407 . . . . 0.0 112.13 -179.262 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 23.0 mmt180 -82.44 156.55 24.06 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.247 -0.908 . . . . 0.0 109.579 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.465 ' O ' ' O ' ' A' ' 26' ' ' SER . 43.1 ttm180 -120.23 124.3 45.35 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.303 -0.873 . . . . 0.0 109.495 -179.778 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.465 ' O ' ' O ' ' A' ' 25' ' ' ARG . 1.2 p 55.78 164.48 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.27 -0.894 . . . . 0.0 109.474 179.573 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.535 ' C ' ' H ' ' A' ' 29' ' ' SER . . . 98.89 155.0 28.95 Favored Glycine 0 N--CA 1.49 2.244 0 N-CA-C 109.487 -1.445 . . . . 0.0 109.487 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.529 ' N ' HD12 ' A' ' 28' ' ' LEU . 11.1 mp -58.03 -0.51 0.08 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.205 -1.173 . . . . 0.0 109.462 179.306 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.535 ' H ' ' C ' ' A' ' 27' ' ' GLY . 3.8 t -104.09 29.01 6.24 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.262 -0.899 . . . . 0.0 109.499 -179.595 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.8 139.9 53.26 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.186 -0.946 . . . . 0.0 109.352 -179.703 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 84.69 -14.61 46.47 Favored Glycine 0 N--CA 1.49 2.256 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 179.88 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 31.6 m170 -78.42 122.13 25.42 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.329 -1.101 . . . . 0.0 109.426 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -108.78 111.94 23.96 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.316 -0.865 . . . . 0.0 109.495 -179.601 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 87.3 m-20 -84.69 139.3 32.11 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.285 -0.884 . . . . 0.0 109.433 179.086 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 42.6 t -113.82 128.74 70.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.298 -0.876 . . . . 0.0 109.453 -179.857 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.417 ' CE2' ' HD3' ' A' ' 46' ' ' ARG . 67.2 m-85 -105.62 142.81 34.71 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.324 -0.86 . . . . 0.0 109.437 179.608 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.552 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 68.4 m-85 -109.66 144.5 37.93 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.285 -0.884 . . . . 0.0 109.44 -179.406 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 -128.22 141.81 51.35 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.246 -0.909 . . . . 0.0 109.543 -179.485 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.461 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.4 OUTLIER -99.95 177.04 1.66 Allowed Pre-proline 0 N--CA 1.489 1.52 0 O-C-N 121.254 -0.904 . . . . 0.0 109.506 179.485 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.461 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 47.1 Cg_exo -55.45 -35.43 92.1 Favored 'Trans proline' 0 C--N 1.306 -1.704 0 C-N-CA 122.77 2.313 . . . . 0.0 112.31 -178.976 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 68.1 m -80.35 -4.4 53.31 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.206 -0.934 . . . . 0.0 109.482 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 89.42 16.0 57.78 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 179.722 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -66.75 122.15 17.02 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.262 -1.14 . . . . 0.0 109.471 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.403 ' CE ' ' CD2' ' A' ' 36' ' ' PHE . 87.4 tttt -93.99 123.03 37.09 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.267 -0.896 . . . . 0.0 109.472 179.306 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.609 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 1.6 p90 -140.92 148.37 40.32 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.335 -0.853 . . . . 0.0 109.418 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.417 ' HD3' ' CE2' ' A' ' 36' ' ' PHE . 65.7 ttp85 -134.07 65.46 1.57 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.184 -0.947 . . . . 0.0 109.508 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.9 m -150.12 130.28 13.6 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.231 -0.918 . . . . 0.0 109.452 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.719 ' N ' ' HD2' ' A' ' 49' ' ' PRO . 24.1 tttt -62.8 -54.08 50.43 Favored Pre-proline 0 N--CA 1.49 1.53 0 O-C-N 121.279 -0.888 . . . . 0.0 109.489 -179.857 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.719 ' HD2' ' N ' ' A' ' 48' ' ' LYS . 18.9 Cg_endo -57.65 -38.66 92.65 Favored 'Trans proline' 0 C--N 1.306 -1.692 0 C-N-CA 122.792 2.328 . . . . 0.0 112.198 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -65.39 -39.73 92.57 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.28 -0.887 . . . . 0.0 109.5 179.833 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.779 ' O ' HD23 ' A' ' 51' ' ' LEU . 5.1 tt -69.29 -41.15 77.2 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.26 -0.9 . . . . 0.0 109.536 179.797 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.576 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -62.62 -43.02 99.86 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.185 -0.947 . . . . 0.0 109.472 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.493 HH12 ' HB2' ' A' ' 49' ' ' PRO . 92.6 mtm-85 -59.45 -42.51 92.14 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.306 -0.871 . . . . 0.0 109.479 179.492 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -59.78 -50.23 74.63 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.396 -0.815 . . . . 0.0 109.508 179.127 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.577 HD11 ' CG ' ' A' ' 14' ' ' PRO . 3.6 mm? -85.78 -0.13 54.43 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.186 -0.946 . . . . 0.0 109.491 178.383 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.576 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -61.87 97.6 0.16 Allowed Glycine 0 N--CA 1.492 2.367 0 N-CA-C 109.506 -1.438 . . . . 0.0 109.506 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 132.26 -63.98 0.62 Allowed Glycine 0 N--CA 1.489 2.226 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 76.2 p -69.88 -24.75 63.46 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.182 -1.187 . . . . 0.0 109.574 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.569 ' HB3' HD12 ' A' ' 55' ' ' LEU . 55.1 ttm -159.3 149.5 19.13 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.229 -0.92 . . . . 0.0 109.475 -179.717 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.569 ' C ' HD12 ' A' ' 61' ' ' LEU . 49.8 t0 -95.16 117.04 29.54 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.235 -0.916 . . . . 0.0 109.45 179.63 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.569 HD12 ' C ' ' A' ' 60' ' ' ASP . 10.7 mp -113.44 10.23 18.24 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.336 -0.853 . . . . 0.0 109.433 -179.392 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 50.3 m -52.44 -37.28 56.54 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.234 -0.916 . . . . 0.0 109.463 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 17.9 p -92.62 18.83 8.11 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.188 -0.945 . . . . 0.0 109.485 179.549 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.563 ' CE1' ' HB3' ' A' ' 12' ' ' ALA . 70.0 t80 -90.99 132.58 35.9 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.19 -0.944 . . . . 0.0 109.387 179.628 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.503 ' O ' ' N ' ' A' ' 69' ' ' GLY . 60.7 t0 -82.63 112.65 19.71 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.205 -0.935 . . . . 0.0 109.563 179.911 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.552 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 73.7 t80 -75.17 -44.3 47.43 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.207 -0.933 . . . . 0.0 109.417 -179.23 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 13.7 tpt180 -58.06 -44.5 87.49 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.263 -0.898 . . . . 0.0 109.423 -179.118 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.452 ' OG1' ' CG ' ' A' ' 65' ' ' ASP . 49.7 p -97.13 -12.94 22.49 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.292 -0.88 . . . . 0.0 109.468 -179.288 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.503 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 61.65 40.86 99.32 Favored Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -130.77 156.24 45.3 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.314 -1.109 . . . . 0.0 109.453 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.483 ' HB2' ' HB2' ' A' ' 12' ' ' ALA . 5.4 ttm -94.98 120.43 35.18 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.267 -0.895 . . . . 0.0 109.492 179.852 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.448 HD22 ' HA ' ' A' ' 72' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.573 0 O-C-N 121.269 -0.894 . . . . 0.0 109.424 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.529 4.841 0 N-CA-C 119.473 2.549 . . . . 0.0 119.473 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.463 ' OG ' ' N ' ' A' ' 3' ' ' MET . 71.2 p -125.47 -65.02 1.03 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.251 -1.146 . . . . 0.0 109.512 -179.803 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.463 ' N ' ' OG ' ' A' ' 2' ' ' SER . 77.8 mtm -84.92 135.63 33.97 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.229 -0.919 . . . . 0.0 109.417 -179.548 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -64.55 142.36 58.45 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.27 -0.894 . . . . 0.0 109.457 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.419 ' HD2' ' N ' ' A' ' 5' ' ' ARG . 11.7 mpt_? -51.73 178.65 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.189 -0.945 . . . . 0.0 109.398 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.58 96.84 7.63 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.263 -0.898 . . . . 0.0 109.529 -179.6 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.444 ' O ' ' CG ' ' A' ' 8' ' ' TRP . 99.3 mtt180 -71.81 167.59 19.65 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.254 -0.904 . . . . 0.0 109.5 179.604 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.444 ' CG ' ' O ' ' A' ' 7' ' ' ARG . 0.8 OUTLIER -166.21 144.66 5.66 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.17 -0.956 . . . . 0.0 109.514 -179.716 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.465 ' N ' ' OE1' ' A' ' 9' ' ' GLU . 58.7 mp0 -92.56 137.05 32.7 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.25 -0.906 . . . . 0.0 109.454 179.73 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.539 ' SG ' ' O ' ' A' ' 69' ' ' GLY . 0.5 OUTLIER -115.11 101.44 54.49 Favored Pre-proline 0 N--CA 1.49 1.529 0 O-C-N 121.301 -0.874 . . . . 0.0 109.567 -179.831 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -51.3 -37.79 60.83 Favored 'Trans proline' 0 C--N 1.306 -1.683 0 C-N-CA 122.872 2.381 . . . . 0.0 112.208 179.743 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.94 -24.3 64.25 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.213 -0.929 . . . . 0.0 109.511 179.387 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 7.2 mp -87.41 157.13 53.43 Favored Pre-proline 0 N--CA 1.49 1.554 0 O-C-N 121.324 -0.86 . . . . 0.0 109.542 179.491 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.461 ' HG2' ' CD1' ' A' ' 17' ' ' TRP . 18.0 Cg_endo -59.8 140.76 94.79 Favored 'Trans proline' 0 C--N 1.305 -1.742 0 C-N-CA 122.802 2.334 . . . . 0.0 112.172 -179.694 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -53.18 121.49 7.61 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.279 -0.888 . . . . 0.0 109.524 -179.175 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 122.6 -27.48 5.98 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 179.276 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' TRP . . . . . 0.461 ' CD1' ' HG2' ' A' ' 14' ' ' PRO . 11.5 m95 -83.69 154.45 23.65 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.343 -1.093 . . . . 0.0 109.553 179.728 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -143.68 157.94 44.03 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.325 -0.86 . . . . 0.0 109.455 -179.436 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.57 ' NH1' ' O ' ' A' ' 69' ' ' GLY . 33.8 ptt180 -124.42 163.56 21.53 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.244 -0.91 . . . . 0.0 109.485 179.777 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -141.8 140.92 33.13 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.284 -0.885 . . . . 0.0 109.571 -179.172 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 28.5 tp10 -101.89 122.36 43.86 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.317 -0.865 . . . . 0.0 109.438 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.419 HG13 ' HE ' ' A' ' 5' ' ' ARG . 2.5 t -118.25 98.47 51.41 Favored Pre-proline 0 N--CA 1.49 1.529 0 O-C-N 121.17 -0.956 . . . . 0.0 109.639 -179.778 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -58.58 128.04 26.8 Favored 'Trans proline' 0 C--N 1.305 -1.712 0 C-N-CA 122.851 2.367 . . . . 0.0 112.184 179.387 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.421 ' NE ' ' HB2' ' A' ' 34' ' ' ASP . 99.5 mtt180 -90.31 164.19 14.45 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.148 -0.97 . . . . 0.0 109.462 178.844 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 89.7 mtm180 -136.75 25.3 3.09 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.362 -0.836 . . . . 0.0 109.418 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.92 178.6 4.81 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.312 -0.868 . . . . 0.0 109.51 -179.837 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -68.8 -84.23 0.14 Allowed Glycine 0 N--CA 1.489 2.227 0 N-CA-C 109.489 -1.444 . . . . 0.0 109.489 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.517 HD22 ' N ' ' A' ' 28' ' ' LEU . 3.8 mm? -61.95 -38.71 89.53 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.162 -1.199 . . . . 0.0 109.511 -179.454 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -76.08 22.55 0.15 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.204 -0.935 . . . . 0.0 109.432 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.451 ' H ' ' C ' ' A' ' 28' ' ' LEU . . . -71.26 142.62 50.53 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.109 -0.995 . . . . 0.0 109.432 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 77.16 -12.51 12.36 Favored Glycine 0 N--CA 1.492 2.389 0 N-CA-C 109.514 -1.434 . . . . 0.0 109.514 179.884 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 73.6 m80 -75.73 130.46 38.71 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.221 -1.164 . . . . 0.0 109.475 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 94.9 mtt-85 -110.59 121.51 45.5 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.26 -0.9 . . . . 0.0 109.518 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.421 ' HB2' ' NE ' ' A' ' 24' ' ' ARG . 58.6 t0 -84.38 136.68 33.78 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.318 -0.864 . . . . 0.0 109.474 179.32 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 25.0 t -111.06 128.16 67.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.267 -0.896 . . . . 0.0 109.502 -179.128 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 52.9 m-85 -117.44 147.15 42.97 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.245 -0.909 . . . . 0.0 109.499 179.098 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 -117.8 148.96 41.58 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.195 -0.941 . . . . 0.0 109.363 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.425 ' CD1' ' N ' ' A' ' 38' ' ' TYR . 12.9 m-85 -133.21 144.59 49.9 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.216 -0.928 . . . . 0.0 109.579 -178.759 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.6 p -103.38 159.44 29.28 Favored Pre-proline 0 N--CA 1.491 1.584 0 O-C-N 121.24 -0.913 . . . . 0.0 109.474 179.051 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -54.01 -16.36 9.01 Favored 'Trans proline' 0 C--N 1.304 -1.779 0 C-N-CA 122.788 2.325 . . . . 0.0 112.271 178.286 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 4.5 m -86.15 -2.16 58.09 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.242 -0.911 . . . . 0.0 109.526 179.081 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 84.83 5.83 85.94 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 41.6 tttp -75.67 119.61 19.93 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.255 -1.144 . . . . 0.0 109.38 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -93.53 121.98 35.49 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.221 -0.924 . . . . 0.0 109.487 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.456 ' CZ ' ' CZ3' ' A' ' 17' ' ' TRP . 2.7 p90 -141.0 149.69 42.09 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.252 -0.905 . . . . 0.0 109.437 178.865 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.696 ' O ' ' C ' ' A' ' 47' ' ' SER . 70.8 ttp85 -124.58 -72.54 0.67 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.321 -0.862 . . . . 0.0 109.463 179.815 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.696 ' C ' ' O ' ' A' ' 46' ' ' ARG . 0.7 OUTLIER -21.26 130.41 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.321 -0.862 . . . . 0.0 109.503 179.664 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.656 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 4.8 tttm -65.74 -42.79 57.01 Favored Pre-proline 0 N--CA 1.491 1.584 0 O-C-N 121.171 -0.956 . . . . 0.0 109.498 179.866 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.656 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 49.8 Cg_exo -54.77 -49.62 16.12 Favored 'Trans proline' 0 C--N 1.306 -1.704 0 C-N-CA 122.831 2.354 . . . . 0.0 112.253 -179.521 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.422 ' HG2' ' N ' ' A' ' 51' ' ' LEU . 0.6 OUTLIER -68.01 -33.78 75.25 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.282 -0.886 . . . . 0.0 109.546 179.765 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.422 ' N ' ' HG2' ' A' ' 50' ' ' GLN . 6.9 tt -62.55 -43.88 97.73 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.281 -0.887 . . . . 0.0 109.46 179.68 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -69.84 -40.21 75.95 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.238 -0.914 . . . . 0.0 109.503 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 70.8 ttp85 -58.44 -44.15 89.04 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.291 -0.881 . . . . 0.0 109.535 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 42.8 t80 -59.54 -50.68 72.98 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.228 -0.92 . . . . 0.0 109.545 179.51 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.406 HD21 ' CZ2' ' A' ' 17' ' ' TRP . 80.1 mt -58.12 -43.15 87.05 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.158 -0.964 . . . . 0.0 109.47 179.278 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.412 ' O ' ' C ' ' A' ' 57' ' ' GLY . . . 65.35 83.07 0.1 OUTLIER Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 179.086 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLY . . . . . 0.412 ' C ' ' O ' ' A' ' 56' ' ' GLY . . . 44.08 72.95 0.28 Allowed Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.515 -1.434 . . . . 0.0 109.515 179.058 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 6.9 m -119.5 -26.7 5.71 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.256 -1.144 . . . . 0.0 109.509 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.587 ' SD ' HD21 ' A' ' 61' ' ' LEU . 0.2 OUTLIER -169.34 160.0 9.12 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.29 -0.881 . . . . 0.0 109.506 179.94 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 50.5 t0 -80.6 92.36 5.94 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.345 -0.847 . . . . 0.0 109.5 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.587 HD21 ' SD ' ' A' ' 59' ' ' MET . 96.0 mt -100.98 -0.56 36.35 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.279 -0.888 . . . . 0.0 109.402 -179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 5.0 t -54.4 -30.84 53.49 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.268 -0.895 . . . . 0.0 109.522 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 76.0 p -92.27 11.49 25.63 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.225 -0.922 . . . . 0.0 109.437 179.723 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.41 ' CZ ' ' C ' ' A' ' 69' ' ' GLY . 74.3 t80 -86.89 131.78 34.01 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.27 -0.894 . . . . 0.0 109.519 -179.74 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.518 ' O ' ' N ' ' A' ' 69' ' ' GLY . 55.8 t0 -82.94 114.82 21.48 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.266 -0.896 . . . . 0.0 109.478 -179.629 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 24.2 t80 -75.18 -47.42 28.45 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.179 -0.95 . . . . 0.0 109.523 -179.505 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 7.7 mmt85 -55.22 -42.33 73.23 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.133 -0.98 . . . . 0.0 109.478 -179.002 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.404 ' OG1' ' CG ' ' A' ' 65' ' ' ASP . 33.2 p -98.69 -13.97 20.02 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.223 -0.923 . . . . 0.0 109.53 -179.455 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.57 ' O ' ' NH1' ' A' ' 19' ' ' ARG . . . 61.07 40.85 99.1 Favored Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 179.777 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -134.8 153.77 51.89 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.297 -1.12 . . . . 0.0 109.492 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 12.8 ttm -87.41 126.28 34.78 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.271 -0.893 . . . . 0.0 109.479 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 72' ' ' LEU . 97.0 mt . . . . . 0 N--CA 1.489 1.506 0 O-C-N 121.239 -0.913 . . . . 0.0 109.501 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.528 4.817 0 N-CA-C 119.405 2.522 . . . . 0.0 119.405 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.6 p -73.14 162.52 29.33 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.262 -1.14 . . . . 0.0 109.552 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 77.3 mtm -83.73 63.16 7.31 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.224 -0.923 . . . . 0.0 109.436 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.486 ' O ' ' O ' ' A' ' 5' ' ' ARG . 17.4 pt-20 -87.43 154.53 20.58 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.257 -0.902 . . . . 0.0 109.432 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.486 ' O ' ' O ' ' A' ' 4' ' ' GLU . 61.0 ttp180 54.02 106.61 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.254 -0.904 . . . . 0.0 109.423 -179.685 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.4 mptt -120.9 113.96 20.87 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.25 -0.906 . . . . 0.0 109.447 179.766 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.448 ' CZ ' ' OE2' ' A' ' 18' ' ' GLU . 14.8 ttp180 -96.36 118.05 32.11 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.285 -0.884 . . . . 0.0 109.468 -179.548 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 5.1 m0 -106.43 156.26 18.72 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.3 -0.875 . . . . 0.0 109.502 179.464 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 84.9 tt0 -72.45 148.73 44.86 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.3 -0.875 . . . . 0.0 109.51 -179.734 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.592 ' SG ' ' CZ ' ' A' ' 19' ' ' ARG . 74.8 m -106.69 104.83 52.86 Favored Pre-proline 0 N--CA 1.49 1.559 0 O-C-N 121.244 -0.91 . . . . 0.0 109.473 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.405 ' HD2' HH22 ' A' ' 19' ' ' ARG . 55.5 Cg_endo -76.56 -21.19 13.24 Favored 'Trans proline' 0 C--N 1.306 -1.671 0 C-N-CA 122.78 2.32 . . . . 0.0 112.241 -179.565 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -84.24 -34.91 23.76 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.225 -0.922 . . . . 0.0 109.498 179.498 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.618 ' CD1' ' N ' ' A' ' 13' ' ' LEU . 4.6 mp -82.6 156.48 68.13 Favored Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.215 -0.928 . . . . 0.0 109.435 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -51.64 140.26 46.24 Favored 'Trans proline' 0 C--N 1.305 -1.722 0 C-N-CA 122.827 2.352 . . . . 0.0 112.192 179.352 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.471 ' CD ' ' H ' ' A' ' 15' ' ' GLN . 1.3 mp0 -45.85 122.85 4.01 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.27 -0.894 . . . . 0.0 109.448 -179.836 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 123.25 -18.86 7.77 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.59 -1.404 . . . . 0.0 109.59 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' TRP . . . . . 0.708 ' CZ2' HD21 ' A' ' 55' ' ' LEU . 26.5 m95 -92.65 151.18 20.24 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.176 -1.191 . . . . 0.0 109.499 179.405 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.448 ' OE2' ' CZ ' ' A' ' 7' ' ' ARG . 71.3 mt-10 -148.89 162.51 39.71 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.181 -0.949 . . . . 0.0 109.487 -179.399 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.592 ' CZ ' ' SG ' ' A' ' 10' ' ' CYS . 10.9 ptp85 -140.04 146.11 38.57 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.298 -0.876 . . . . 0.0 109.492 179.58 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -139.13 146.71 40.98 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.203 -0.935 . . . . 0.0 109.471 -178.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -103.1 140.14 37.7 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.311 -0.868 . . . . 0.0 109.47 178.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.0 t -141.6 123.48 9.12 Favored Pre-proline 0 N--CA 1.491 1.598 0 O-C-N 121.227 -0.921 . . . . 0.0 109.584 -179.609 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -75.4 135.41 18.33 Favored 'Trans proline' 0 C--N 1.304 -1.767 0 C-N-CA 122.863 2.375 . . . . 0.0 112.153 178.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 18.6 ttm180 -65.27 146.3 55.12 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.176 -0.953 . . . . 0.0 109.527 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 91.8 mtm-85 -136.13 -29.91 0.98 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.224 -0.922 . . . . 0.0 109.503 -178.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 34.8 t -131.64 87.64 2.48 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.199 -0.938 . . . . 0.0 109.488 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -177.72 160.64 27.32 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.56 -1.416 . . . . 0.0 109.56 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.406 ' C ' ' H ' ' A' ' 30' ' ' ALA . 97.2 mt -64.66 -42.96 95.03 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.217 -1.166 . . . . 0.0 109.476 -179.642 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.518 ' O ' ' O ' ' A' ' 30' ' ' ALA . 2.0 m -70.76 6.9 1.28 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.251 -0.906 . . . . 0.0 109.48 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.518 ' O ' ' O ' ' A' ' 29' ' ' SER . . . -34.92 155.21 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.194 -0.941 . . . . 0.0 109.49 179.157 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 100.29 -37.54 3.52 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 -179.47 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 73.9 m80 -89.55 166.12 13.85 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.201 -1.176 . . . . 0.0 109.477 179.485 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 17.2 ptp180 -117.7 134.59 54.74 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.214 -0.929 . . . . 0.0 109.486 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -105.2 141.88 35.95 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.281 -0.887 . . . . 0.0 109.45 -179.057 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 43.6 t -109.76 135.71 47.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.236 -0.915 . . . . 0.0 109.414 179.615 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 55.3 m-85 -121.96 144.18 49.03 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.17 -0.956 . . . . 0.0 109.49 -179.576 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.582 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 54.6 m-85 -115.68 147.89 40.34 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.284 -0.885 . . . . 0.0 109.475 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 36.4 m-85 -127.25 141.04 51.82 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.297 -0.877 . . . . 0.0 109.456 -179.524 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.458 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.4 OUTLIER -98.86 177.64 1.52 Allowed Pre-proline 0 N--CA 1.49 1.553 0 O-C-N 121.375 -0.828 . . . . 0.0 109.397 179.448 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.458 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 53.0 Cg_exo -54.36 -34.67 81.57 Favored 'Trans proline' 0 C--N 1.305 -1.726 0 C-N-CA 122.861 2.374 . . . . 0.0 112.322 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 46.6 t -85.8 1.16 50.8 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.298 -0.876 . . . . 0.0 109.468 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 85.41 15.86 65.5 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 81.9 tttt -66.52 121.54 15.57 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.189 -1.183 . . . . 0.0 109.514 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 62.4 tttm -92.77 124.85 37.07 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.206 -0.933 . . . . 0.0 109.506 179.612 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.553 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 2.3 p90 -139.88 146.12 38.89 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.264 -0.898 . . . . 0.0 109.455 -179.721 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 14.9 ptm180 -136.64 59.57 1.69 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.233 -0.917 . . . . 0.0 109.493 179.296 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.7 p -153.35 137.65 16.6 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.324 -0.86 . . . . 0.0 109.476 179.563 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.607 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 0.9 OUTLIER -66.52 -46.23 58.34 Favored Pre-proline 0 N--CA 1.489 1.499 0 O-C-N 121.314 -0.866 . . . . 0.0 109.503 -179.298 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.607 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 44.3 Cg_exo -55.83 -48.88 17.71 Favored 'Trans proline' 0 C--N 1.305 -1.738 0 C-N-CA 122.855 2.37 . . . . 0.0 112.261 -178.817 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -65.76 -37.42 86.29 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.229 -0.919 . . . . 0.0 109.502 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 44.5 tp -65.75 -47.57 74.78 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.286 -0.883 . . . . 0.0 109.553 -179.31 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.648 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -67.01 -45.55 77.23 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.324 -0.86 . . . . 0.0 109.51 -179.58 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 62.6 ttp180 -60.68 -45.54 93.75 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.173 -0.954 . . . . 0.0 109.514 -179.637 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 25.5 t80 -63.08 -52.57 62.2 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.301 -0.874 . . . . 0.0 109.479 -179.066 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.708 HD21 ' CZ2' ' A' ' 17' ' ' TRP . 98.0 mt -88.7 3.98 48.87 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.21 -0.931 . . . . 0.0 109.447 -179.922 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.648 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -61.89 -39.66 97.81 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.49 -1.444 . . . . 0.0 109.49 -179.621 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -83.23 2.35 87.19 Favored Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.51 -1.436 . . . . 0.0 109.51 -179.562 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 79.3 p -119.13 -23.31 6.86 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.326 -1.103 . . . . 0.0 109.457 -179.643 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 8.3 ttm -176.49 168.99 2.68 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.29 -0.881 . . . . 0.0 109.459 -179.616 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.517 ' C ' HD22 ' A' ' 61' ' ' LEU . 93.5 m-20 -96.39 114.57 26.26 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.226 -0.921 . . . . 0.0 109.5 179.382 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.567 HD22 ' N ' ' A' ' 61' ' ' LEU . 3.6 mm? -98.31 4.69 48.68 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.231 -0.918 . . . . 0.0 109.49 -179.404 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 77.5 p -58.03 -38.26 75.9 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.252 -0.905 . . . . 0.0 109.46 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 19.6 p -87.56 6.21 35.5 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.269 -0.894 . . . . 0.0 109.463 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.416 ' CZ ' ' HA2' ' A' ' 69' ' ' GLY . 55.6 t80 -91.88 122.88 34.82 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.22 -0.925 . . . . 0.0 109.448 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.451 ' O ' ' N ' ' A' ' 69' ' ' GLY . 97.5 m-20 -75.35 114.38 13.82 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.25 -0.906 . . . . 0.0 109.493 179.805 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.582 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 81.9 t80 -77.76 -41.03 38.98 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.227 -0.921 . . . . 0.0 109.497 -179.378 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -61.56 -45.12 95.5 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.198 -0.939 . . . . 0.0 109.459 -179.801 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 46.0 p -95.06 -15.53 23.37 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.229 -0.919 . . . . 0.0 109.499 -179.505 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.451 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 63.92 44.64 95.75 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.57 -1.412 . . . . 0.0 109.57 -179.683 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 64.8 mttp -142.22 158.27 43.92 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.224 -1.163 . . . . 0.0 109.444 -179.338 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 1.2 mmt -79.69 136.81 36.88 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.232 -0.917 . . . . 0.0 109.435 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.43 HD12 ' HA ' ' A' ' 72' ' ' LEU . 48.9 tp . . . . . 0 N--CA 1.489 1.496 0 O-C-N 121.177 -0.952 . . . . 0.0 109.499 -179.712 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.529 4.867 0 N-CA-C 119.443 2.537 . . . . 0.0 119.443 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 35.4 t -62.65 -43.4 98.91 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.211 -1.17 . . . . 0.0 109.471 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 2.2 tpp -129.91 80.24 1.95 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.204 -0.935 . . . . 0.0 109.444 -179.716 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -95.89 132.83 40.77 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.256 -0.903 . . . . 0.0 109.524 179.457 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 95.3 mtt-85 -89.92 128.54 36.23 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.288 -0.882 . . . . 0.0 109.424 -179.77 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 73.6 mttt -72.98 153.7 40.83 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.288 -0.883 . . . . 0.0 109.445 179.844 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.584 ' O ' ' CD1' ' A' ' 8' ' ' TRP . 51.4 ptt85 -149.37 140.88 23.36 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.181 -0.949 . . . . 0.0 109.506 -179.309 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.584 ' CD1' ' O ' ' A' ' 7' ' ' ARG . 7.0 m0 -147.95 129.16 14.67 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.264 -0.897 . . . . 0.0 109.513 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -99.63 127.36 45.73 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.306 -0.871 . . . . 0.0 109.458 179.523 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.475 ' HB3' ' HE ' ' A' ' 19' ' ' ARG . 4.7 t -103.47 134.79 19.56 Favored Pre-proline 0 N--CA 1.491 1.619 0 O-C-N 121.277 -0.89 . . . . 0.0 109.414 -179.629 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -69.54 -14.07 36.22 Favored 'Trans proline' 0 C--N 1.306 -1.696 0 C-N-CA 122.861 2.374 . . . . 0.0 112.194 -179.677 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.458 ' C ' HD22 ' A' ' 13' ' ' LEU . . . -69.39 -34.68 74.88 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.174 -0.954 . . . . 0.0 109.462 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.661 HD22 ' N ' ' A' ' 13' ' ' LEU . 2.6 mm? -91.02 150.47 41.84 Favored Pre-proline 0 N--CA 1.489 1.523 0 O-C-N 121.18 -0.95 . . . . 0.0 109.437 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.402 ' HG2' ' CD1' ' A' ' 17' ' ' TRP . 28.3 Cg_endo -63.94 156.98 55.2 Favored 'Trans proline' 0 C--N 1.305 -1.725 0 C-N-CA 122.748 2.298 . . . . 0.0 112.219 -179.852 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 55.7 tt0 -53.29 128.02 26.72 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.227 -0.921 . . . . 0.0 109.451 -179.734 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 124.82 -23.64 6.21 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.589 -1.404 . . . . 0.0 109.589 179.782 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' TRP . . . . . 0.448 ' CH2' ' CD2' ' A' ' 55' ' ' LEU . 49.9 m95 -87.64 143.66 27.07 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.294 -1.121 . . . . 0.0 109.406 179.708 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -143.55 156.7 44.68 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.27 -0.894 . . . . 0.0 109.515 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.532 HH21 HD23 ' A' ' 13' ' ' LEU . 53.0 mtt-85 -129.38 129.44 44.75 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.292 -0.88 . . . . 0.0 109.447 179.038 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -134.04 140.43 46.66 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.273 -0.892 . . . . 0.0 109.515 -179.342 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -104.57 149.05 25.84 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.246 -0.909 . . . . 0.0 109.428 178.595 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 4.7 t -145.84 124.76 6.61 Favored Pre-proline 0 N--CA 1.491 1.625 0 O-C-N 121.209 -0.932 . . . . 0.0 109.598 -179.43 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -75.32 136.47 19.8 Favored 'Trans proline' 0 C--N 1.304 -1.784 0 C-N-CA 122.849 2.366 . . . . 0.0 112.133 179.211 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 6.4 tpt180 -62.92 147.02 51.61 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.248 -0.907 . . . . 0.0 109.496 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 73.1 ttt-85 -135.01 -33.82 0.9 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.276 -0.89 . . . . 0.0 109.519 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 76.4 p -136.52 104.34 5.54 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.23 -0.919 . . . . 0.0 109.486 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 173.32 172.33 38.72 Favored Glycine 0 N--CA 1.489 2.219 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 58.2 tp -63.78 -42.52 97.75 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.259 -1.142 . . . . 0.0 109.471 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.476 ' O ' ' C ' ' A' ' 30' ' ' ALA . 99.2 p -84.21 10.92 9.12 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.282 -0.886 . . . . 0.0 109.481 -179.515 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.476 ' C ' ' O ' ' A' ' 29' ' ' SER . . . -38.94 131.37 1.39 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.308 -0.87 . . . . 0.0 109.497 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 122.83 -40.3 2.05 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 80.4 m80 -81.66 174.56 11.26 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.341 -1.094 . . . . 0.0 109.451 179.425 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 88.0 mtm-85 -118.94 136.68 53.95 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.175 -0.953 . . . . 0.0 109.492 179.64 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 93.4 m-20 -116.61 141.31 48.36 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.278 -0.889 . . . . 0.0 109.444 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.6 t -105.19 132.79 51.16 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.26 -0.9 . . . . 0.0 109.435 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -120.76 143.3 48.88 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.223 -0.923 . . . . 0.0 109.51 179.621 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 50.6 m-85 -118.63 146.64 44.5 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.209 -0.932 . . . . 0.0 109.437 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -127.71 138.36 52.77 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.241 -0.912 . . . . 0.0 109.552 -179.572 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.498 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.4 OUTLIER -99.85 179.32 1.06 Allowed Pre-proline 0 N--CA 1.49 1.545 0 O-C-N 121.194 -0.941 . . . . 0.0 109.504 179.147 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.498 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 40.2 Cg_exo -56.43 -32.59 89.54 Favored 'Trans proline' 0 C--N 1.305 -1.76 0 C-N-CA 122.81 2.34 . . . . 0.0 112.289 -179.628 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 7.4 m -87.08 5.13 39.16 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.369 -0.832 . . . . 0.0 109.594 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 81.43 10.07 85.03 Favored Glycine 0 N--CA 1.49 2.234 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 64.9 tttp -62.89 119.43 9.37 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.238 -1.154 . . . . 0.0 109.492 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.97 123.33 39.52 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.217 -0.927 . . . . 0.0 109.429 179.045 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 41.8 p90 -141.02 147.05 38.05 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.239 -0.913 . . . . 0.0 109.493 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 44.7 ptt85 -130.6 56.05 1.79 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.253 -0.904 . . . . 0.0 109.51 179.499 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -159.33 146.77 17.19 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.193 -0.942 . . . . 0.0 109.522 -179.84 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.655 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 0.5 OUTLIER -68.87 -42.87 25.38 Favored Pre-proline 0 N--CA 1.49 1.562 0 O-C-N 121.207 -0.933 . . . . 0.0 109.504 -179.581 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.655 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 51.0 Cg_exo -55.01 -44.63 47.81 Favored 'Trans proline' 0 C--N 1.306 -1.686 0 C-N-CA 122.761 2.307 . . . . 0.0 112.231 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 18.2 mm100 -71.32 -37.0 71.79 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.229 -0.919 . . . . 0.0 109.445 179.141 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.722 ' O ' HD23 ' A' ' 51' ' ' LEU . 3.8 tt -63.44 -47.36 82.21 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.263 -0.898 . . . . 0.0 109.502 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -66.15 -41.91 89.74 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.182 -0.949 . . . . 0.0 109.497 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 77.7 ttt-85 -56.45 -45.39 80.86 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.223 -0.923 . . . . 0.0 109.511 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -66.24 -50.0 65.27 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.325 -0.86 . . . . 0.0 109.455 179.284 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.448 ' CD2' ' CH2' ' A' ' 17' ' ' TRP . 4.2 mm? -70.9 -3.32 18.62 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.199 -0.938 . . . . 0.0 109.415 179.704 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.711 ' O ' ' N ' ' A' ' 58' ' ' SER . . . -50.87 161.68 1.28 Allowed Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.534 -1.426 . . . . 0.0 109.534 179.771 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 59.38 -61.04 0.01 OUTLIER Glycine 0 N--CA 1.489 2.226 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 -179.529 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.711 ' N ' ' O ' ' A' ' 56' ' ' GLY . 80.7 p -60.88 -28.96 69.27 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.273 -1.133 . . . . 0.0 109.463 -178.761 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.429 ' CB ' ' O ' ' A' ' 58' ' ' SER . 2.8 mtp 169.45 126.88 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.219 -0.926 . . . . 0.0 109.452 -179.479 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.794 ' O ' HD12 ' A' ' 61' ' ' LEU . 62.0 t0 -70.62 151.74 44.66 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.313 -0.867 . . . . 0.0 109.424 179.312 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.794 HD12 ' O ' ' A' ' 60' ' ' ASP . 3.7 mp -133.19 24.87 4.2 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.273 -0.892 . . . . 0.0 109.494 -179.04 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 58.0 m -52.61 -32.68 42.85 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.148 -0.97 . . . . 0.0 109.484 -179.584 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' THR . . . . . 0.509 ' O ' ' SD ' ' A' ' 71' ' ' MET . 19.8 p -94.71 35.14 1.26 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.227 -0.92 . . . . 0.0 109.481 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 93.1 t80 -99.05 129.06 45.3 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.259 -0.901 . . . . 0.0 109.455 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 91.7 m-20 -81.9 114.29 20.41 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.253 -0.904 . . . . 0.0 109.375 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -76.45 -41.13 48.47 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.305 -0.872 . . . . 0.0 109.476 -179.549 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 23.1 mmm180 -63.24 -36.34 83.35 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.312 -0.868 . . . . 0.0 109.444 -178.685 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 19.5 p -95.53 -16.04 22.45 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.299 -0.875 . . . . 0.0 109.476 -179.414 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 64.64 36.48 93.19 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.571 -1.412 . . . . 0.0 109.571 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.8 mtmp? -145.87 162.52 37.54 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.355 -1.085 . . . . 0.0 109.439 -179.573 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.509 ' SD ' ' O ' ' A' ' 63' ' ' THR . 9.6 tpp -80.84 128.33 33.54 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.235 -0.916 . . . . 0.0 109.534 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.537 HD23 ' C ' ' A' ' 72' ' ' LEU . 3.5 tt . . . . . 0 N--CA 1.491 1.605 0 O-C-N 121.336 -0.852 . . . . 0.0 109.472 -179.763 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.53 4.962 0 N-CA-C 119.442 2.537 . . . . 0.0 119.442 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 50.24 93.32 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.312 -1.111 . . . . 0.0 109.519 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 97.4 mtp -83.03 131.77 35.16 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.182 -0.949 . . . . 0.0 109.495 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.504 ' O ' ' O ' ' A' ' 5' ' ' ARG . 96.0 mt-10 -79.74 -170.84 2.57 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.23 -0.919 . . . . 0.0 109.451 179.625 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.504 ' O ' ' O ' ' A' ' 4' ' ' GLU . 84.5 mtp180 55.17 110.9 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.207 -0.933 . . . . 0.0 109.422 -179.802 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.405 ' O ' ' HA ' ' A' ' 20' ' ' GLU . 26.3 mmtp -109.49 101.0 9.99 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.234 -0.916 . . . . 0.0 109.495 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 41.1 ttm180 -98.35 118.69 35.56 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.225 -0.922 . . . . 0.0 109.392 -179.712 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.555 ' CD1' ' N ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -132.53 152.03 51.71 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.239 -0.913 . . . . 0.0 109.503 179.284 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 79.3 tt0 -90.91 141.78 28.46 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.301 -0.874 . . . . 0.0 109.473 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -108.25 159.49 30.48 Favored Pre-proline 0 N--CA 1.49 1.533 0 O-C-N 121.336 -0.853 . . . . 0.0 109.454 179.841 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -65.05 -20.62 63.72 Favored 'Trans proline' 0 C--N 1.304 -1.764 0 C-N-CA 122.855 2.37 . . . . 0.0 112.237 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.566 ' HB3' ' CE1' ' A' ' 64' ' ' PHE . . . -93.29 -4.92 50.88 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.165 -0.959 . . . . 0.0 109.473 179.723 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.507 HD23 ' CA ' ' A' ' 18' ' ' GLU . 8.7 mp -98.95 113.41 64.54 Favored Pre-proline 0 N--CA 1.491 1.601 0 O-C-N 121.184 -0.948 . . . . 0.0 109.46 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.731 ' HG2' HD11 ' A' ' 55' ' ' LEU . 49.1 Cg_exo -50.75 155.51 5.5 Favored 'Trans proline' 0 C--N 1.306 -1.707 0 C-N-CA 122.756 2.304 . . . . 0.0 112.261 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -49.93 106.8 0.13 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.305 -0.872 . . . . 0.0 109.523 179.842 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 125.89 -25.23 5.59 Favored Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.621 -1.392 . . . . 0.0 109.621 179.171 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' TRP . . . . . 0.436 ' CE2' ' HD3' ' A' ' 40' ' ' PRO . 47.6 m95 -92.86 139.7 30.27 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.302 -1.116 . . . . 0.0 109.467 178.385 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.507 ' CA ' HD23 ' A' ' 13' ' ' LEU . 96.3 mt-10 -151.73 166.19 32.07 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.211 -0.93 . . . . 0.0 109.501 -178.665 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.511 ' NH1' ' OH ' ' A' ' 37' ' ' TYR . 12.1 ptm180 -140.92 145.86 36.64 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.27 -0.894 . . . . 0.0 109.384 178.887 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.405 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 12.2 pt-20 -132.92 145.98 51.39 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.239 -0.913 . . . . 0.0 109.462 -179.117 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 79.7 tt0 -100.01 136.67 39.55 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.271 -0.893 . . . . 0.0 109.452 178.684 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.5 t -135.4 133.71 20.67 Favored Pre-proline 0 N--CA 1.49 1.566 0 O-C-N 121.158 -0.964 . . . . 0.0 109.584 -178.84 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' PRO . . . . . 0.423 ' O ' ' N ' ' A' ' 25' ' ' ARG . 50.3 Cg_exo -50.11 150.86 9.75 Favored 'Trans proline' 0 C--N 1.304 -1.779 0 C-N-CA 122.821 2.347 . . . . 0.0 112.099 178.296 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.433 ' HD3' ' N ' ' A' ' 31' ' ' GLY . 0.0 OUTLIER -57.38 90.13 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.201 -0.937 . . . . 0.0 109.44 -179.648 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.423 ' N ' ' O ' ' A' ' 23' ' ' PRO . 97.0 mtt180 -56.25 -75.18 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.286 -0.884 . . . . 0.0 109.405 178.768 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 30.9 t -162.37 58.57 0.23 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.277 -0.89 . . . . 0.0 109.464 179.684 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -92.37 172.79 35.05 Favored Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.509 -1.437 . . . . 0.0 109.509 179.584 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.546 ' N ' HD12 ' A' ' 28' ' ' LEU . 10.9 mp -66.15 -40.66 90.74 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.304 -1.115 . . . . 0.0 109.489 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.545 ' O ' ' O ' ' A' ' 30' ' ' ALA . 92.5 p -97.44 20.44 11.66 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.133 -0.979 . . . . 0.0 109.435 -179.614 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.545 ' O ' ' O ' ' A' ' 29' ' ' SER . . . -42.76 170.62 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.27 -0.894 . . . . 0.0 109.466 179.842 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.433 ' N ' ' HD3' ' A' ' 24' ' ' ARG . . . 124.45 -16.45 7.52 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.488 -1.445 . . . . 0.0 109.488 -179.464 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 56.8 m80 -133.11 -146.06 0.26 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.174 -1.192 . . . . 0.0 109.493 179.696 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -116.8 134.77 54.38 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.14 -0.975 . . . . 0.0 109.492 179.556 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.597 ' OD2' ' CE2' ' A' ' 36' ' ' PHE . 9.2 t70 -103.12 140.73 36.94 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.202 -0.936 . . . . 0.0 109.481 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.592 ' O ' ' CD ' ' A' ' 46' ' ' ARG . 97.6 t -119.67 132.12 70.3 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.251 -0.905 . . . . 0.0 109.481 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.597 ' CE2' ' OD2' ' A' ' 34' ' ' ASP . 94.5 m-85 -116.2 150.89 36.76 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.221 -0.925 . . . . 0.0 109.542 -179.674 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.596 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 23.2 m-85 -112.69 147.15 37.39 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.257 -0.902 . . . . 0.0 109.463 179.737 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -126.39 139.44 53.27 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.214 -0.929 . . . . 0.0 109.552 -179.502 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -102.23 174.57 2.78 Favored Pre-proline 0 N--CA 1.489 1.51 0 O-C-N 121.251 -0.906 . . . . 0.0 109.419 179.33 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.436 ' HD3' ' CE2' ' A' ' 17' ' ' TRP . 52.8 Cg_exo -52.79 -35.95 71.59 Favored 'Trans proline' 0 C--N 1.306 -1.699 0 C-N-CA 122.85 2.367 . . . . 0.0 112.225 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 4.2 m -82.48 -1.01 49.02 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.342 -0.848 . . . . 0.0 109.476 -179.639 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 87.15 11.93 68.82 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -70.04 116.14 10.06 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.259 -1.142 . . . . 0.0 109.494 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 20.0 pttp -94.92 132.59 39.58 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.13 -0.981 . . . . 0.0 109.5 178.881 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.443 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 8.5 p90 -141.68 151.8 43.32 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.324 -0.86 . . . . 0.0 109.49 -179.776 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.592 ' CD ' ' O ' ' A' ' 35' ' ' VAL . 24.1 tpt85 -125.26 63.39 1.17 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.175 -0.953 . . . . 0.0 109.494 179.29 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.0 t -150.84 125.66 9.74 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.24 -0.913 . . . . 0.0 109.42 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.716 ' N ' ' HD2' ' A' ' 49' ' ' PRO . 20.1 tttt -65.21 -53.47 40.04 Favored Pre-proline 0 N--CA 1.489 1.48 0 O-C-N 121.233 -0.917 . . . . 0.0 109.506 -179.598 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.716 ' HD2' ' N ' ' A' ' 48' ' ' LYS . 14.5 Cg_endo -56.56 -38.69 94.95 Favored 'Trans proline' 0 C--N 1.304 -1.765 0 C-N-CA 122.877 2.385 . . . . 0.0 112.148 179.19 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -65.5 -35.22 80.23 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.344 -0.848 . . . . 0.0 109.432 179.152 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.807 ' O ' HD23 ' A' ' 51' ' ' LEU . 4.4 tt -68.54 -42.54 78.28 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.277 -0.89 . . . . 0.0 109.491 179.647 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.591 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -62.55 -41.28 98.8 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.268 -0.895 . . . . 0.0 109.463 -179.813 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 71.7 ttp85 -59.5 -48.66 80.79 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.175 -0.953 . . . . 0.0 109.457 179.871 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 6.2 t80 -63.79 -49.08 74.33 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.268 -0.895 . . . . 0.0 109.524 179.431 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.731 HD11 ' HG2' ' A' ' 14' ' ' PRO . 3.3 mm? -81.34 -0.72 42.42 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.161 -0.962 . . . . 0.0 109.451 179.672 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.591 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -62.07 -35.15 91.05 Favored Glycine 0 N--CA 1.489 2.218 0 N-CA-C 109.604 -1.399 . . . . 0.0 109.604 -179.584 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -88.64 -3.12 78.02 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.459 -1.456 . . . . 0.0 109.459 -179.32 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -112.34 -30.7 7.08 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.308 -1.113 . . . . 0.0 109.494 -179.574 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.437 ' O ' ' O ' ' A' ' 55' ' ' LEU . 31.2 ttp -174.58 167.25 3.86 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.286 -0.884 . . . . 0.0 109.471 -179.771 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.544 ' C ' HD12 ' A' ' 61' ' ' LEU . 93.7 m-20 -92.52 113.36 25.61 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.196 -0.94 . . . . 0.0 109.518 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.544 HD12 ' C ' ' A' ' 60' ' ' ASP . 11.1 mp -111.61 9.54 21.11 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.246 -0.909 . . . . 0.0 109.505 -179.803 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 88.5 p -55.78 -34.8 65.59 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.286 -0.884 . . . . 0.0 109.541 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 10.4 p -91.83 24.86 2.98 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.281 -0.887 . . . . 0.0 109.445 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.566 ' CE1' ' HB3' ' A' ' 12' ' ' ALA . 79.9 t80 -91.41 126.18 36.41 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.103 -0.998 . . . . 0.0 109.438 -179.915 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.552 ' O ' ' N ' ' A' ' 69' ' ' GLY . 96.5 m-20 -75.84 111.77 11.54 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.211 -0.93 . . . . 0.0 109.513 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.596 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 66.1 t80 -74.29 -45.01 50.36 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.236 -0.915 . . . . 0.0 109.49 -179.385 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 24.6 mmm180 -63.88 -37.9 89.11 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.2 -0.938 . . . . 0.0 109.471 -178.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.402 ' OG1' ' CB ' ' A' ' 65' ' ' ASP . 5.6 p -98.9 -15.26 19.24 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.297 -0.877 . . . . 0.0 109.538 -179.376 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.552 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 62.3 39.11 97.3 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.634 -1.386 . . . . 0.0 109.634 -179.842 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.456 ' H ' ' HB2' ' A' ' 65' ' ' ASP . 71.7 mmtt -133.42 151.59 51.82 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.216 -1.167 . . . . 0.0 109.413 -179.407 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 6.6 ttm -96.01 124.44 40.02 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.201 -0.937 . . . . 0.0 109.381 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 58.0 tp . . . . . 0 N--CA 1.491 1.614 0 O-C-N 121.274 -0.891 . . . . 0.0 109.428 -179.709 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.452 ' O ' ' C ' ' A' ' 2' ' ' SER . . . . . . . . 1 N--CA 1.531 4.984 0 N-CA-C 119.381 2.512 . . . . 0.0 119.381 . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.452 ' C ' ' O ' ' A' ' 1' ' ' GLY . 1.0 OUTLIER 41.27 35.04 0.37 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.245 -1.15 . . . . 0.0 109.413 179.991 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 67.0 mtt -82.39 142.31 32.07 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.282 -0.886 . . . . 0.0 109.41 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 82.9 tt0 -95.98 127.52 42.07 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.231 -0.918 . . . . 0.0 109.525 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 89.7 mtm180 -75.35 143.41 42.87 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.326 -0.859 . . . . 0.0 109.477 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.434 ' H ' ' HD3' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -72.06 154.86 40.87 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.326 -0.859 . . . . 0.0 109.49 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 62.7 ttp180 -153.3 144.62 23.14 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.229 -0.92 . . . . 0.0 109.388 -179.495 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.627 ' CD1' ' N ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -166.1 139.48 4.18 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.15 -0.969 . . . . 0.0 109.536 -179.331 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -105.8 117.68 34.65 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.179 -0.951 . . . . 0.0 109.472 178.763 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.654 ' N ' HH12 ' A' ' 19' ' ' ARG . 10.1 p -92.37 137.45 24.64 Favored Pre-proline 0 N--CA 1.491 1.608 0 O-C-N 121.319 -0.863 . . . . 0.0 109.416 -178.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -69.89 -16.69 37.09 Favored 'Trans proline' 0 C--N 1.304 -1.794 0 C-N-CA 122.783 2.322 . . . . 0.0 112.262 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.492 ' C ' HD22 ' A' ' 13' ' ' LEU . . . -60.22 -31.76 70.47 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.297 -0.877 . . . . 0.0 109.484 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.626 HD22 ' N ' ' A' ' 13' ' ' LEU . 3.7 mm? -95.39 154.44 39.37 Favored Pre-proline 0 N--CA 1.491 1.604 0 O-C-N 121.346 -0.846 . . . . 0.0 109.477 179.825 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -55.42 144.13 74.19 Favored 'Trans proline' 0 C--N 1.306 -1.704 0 C-N-CA 122.798 2.332 . . . . 0.0 112.165 179.702 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -49.18 129.15 17.72 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.268 -0.895 . . . . 0.0 109.485 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 118.04 -19.89 10.86 Favored Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.594 -1.403 . . . . 0.0 109.594 -179.79 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' TRP . . . . . 0.406 ' CZ2' HD11 ' A' ' 55' ' ' LEU . 20.7 m95 -85.09 144.09 28.45 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.232 -1.158 . . . . 0.0 109.45 -179.903 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -144.63 157.06 44.37 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.253 -0.904 . . . . 0.0 109.477 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.654 HH12 ' N ' ' A' ' 10' ' ' CYS . 32.8 ptt-85 -147.25 152.54 38.48 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.179 -0.951 . . . . 0.0 109.381 179.502 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.401 ' O ' ' CD ' ' A' ' 20' ' ' GLU . 0.0 OUTLIER -150.61 151.0 31.89 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.28 -0.888 . . . . 0.0 109.526 -179.499 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.425 ' OE1' ' CE ' ' A' ' 6' ' ' LYS . 86.4 tt0 -96.57 146.06 25.16 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.268 -0.895 . . . . 0.0 109.326 179.184 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.8 t -144.43 122.79 6.82 Favored Pre-proline 0 N--CA 1.49 1.554 0 O-C-N 121.245 -0.909 . . . . 0.0 109.523 -178.919 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -75.76 136.51 18.99 Favored 'Trans proline' 0 C--N 1.306 -1.693 0 C-N-CA 122.828 2.352 . . . . 0.0 112.214 179.451 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 95.1 mtt-85 -64.64 148.46 50.89 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.18 -0.95 . . . . 0.0 109.534 -179.676 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 91.1 mtm-85 -132.18 -28.42 1.72 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.271 -0.893 . . . . 0.0 109.524 -179.323 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 46.8 t -138.11 97.16 3.33 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.195 -0.941 . . . . 0.0 109.493 179.705 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 176.18 165.57 32.14 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.595 -1.402 . . . . 0.0 109.595 -179.801 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.676 ' CD2' ' H ' ' A' ' 28' ' ' LEU . 0.1 OUTLIER -68.04 -45.06 75.0 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.288 -1.125 . . . . 0.0 109.447 -179.805 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.557 ' O ' ' C ' ' A' ' 30' ' ' ALA . 4.6 m -71.56 3.88 3.56 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.273 -0.892 . . . . 0.0 109.408 -179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.557 ' C ' ' O ' ' A' ' 29' ' ' SER . . . -34.22 152.64 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.257 -0.902 . . . . 0.0 109.54 179.373 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 102.54 -36.6 4.18 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 37.7 m80 -87.15 168.35 13.33 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.23 -1.159 . . . . 0.0 109.461 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.39 139.49 52.73 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.234 -0.916 . . . . 0.0 109.385 -179.837 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.564 ' OD1' ' N ' ' A' ' 35' ' ' VAL . 67.3 t0 -119.37 142.01 48.54 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.269 -0.894 . . . . 0.0 109.455 -179.711 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.564 ' N ' ' OD1' ' A' ' 34' ' ' ASP . 62.7 t -110.58 140.82 27.99 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.246 -0.909 . . . . 0.0 109.397 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 65.0 m-85 -122.52 149.98 43.19 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.245 -0.91 . . . . 0.0 109.498 -179.523 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.562 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 22.3 m-85 -116.58 145.22 43.53 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.289 -0.882 . . . . 0.0 109.408 -179.884 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -120.5 134.87 55.22 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.209 -0.932 . . . . 0.0 109.445 -179.369 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.503 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -97.6 -179.56 0.9 Allowed Pre-proline 0 N--CA 1.491 1.586 0 O-C-N 121.301 -0.875 . . . . 0.0 109.358 179.221 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.503 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 39.2 Cg_exo -56.86 -28.97 79.69 Favored 'Trans proline' 0 C--N 1.306 -1.671 0 C-N-CA 122.836 2.357 . . . . 0.0 112.151 -179.633 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 94.1 p -91.44 2.48 56.38 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.261 -0.899 . . . . 0.0 109.518 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 83.45 14.78 72.95 Favored Glycine 0 N--CA 1.49 2.243 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 179.909 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -70.91 123.98 23.28 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.293 -1.122 . . . . 0.0 109.404 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.675 ' NZ ' HH22 ' A' ' 46' ' ' ARG . 18.6 pttp -95.32 129.6 42.4 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.216 -0.927 . . . . 0.0 109.48 179.202 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.659 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 0.7 OUTLIER -140.52 147.85 40.16 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.316 -0.865 . . . . 0.0 109.431 -179.837 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.675 HH22 ' NZ ' ' A' ' 44' ' ' LYS . 6.2 ptp85 -134.06 57.43 1.81 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.288 -0.882 . . . . 0.0 109.466 179.664 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -150.73 132.48 14.97 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.217 -0.927 . . . . 0.0 109.524 -179.78 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.722 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 2.7 tmtm? -71.25 -39.37 7.9 Favored Pre-proline 0 N--CA 1.491 1.593 0 O-C-N 121.319 -0.863 . . . . 0.0 109.488 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.722 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 33.0 Cg_exo -57.6 -55.17 2.61 Favored 'Trans proline' 0 C--N 1.306 -1.699 0 C-N-CA 122.894 2.396 . . . . 0.0 112.181 -179.556 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 26.7 tt0 -69.34 -31.83 70.53 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.274 -0.891 . . . . 0.0 109.474 179.437 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.754 HD23 ' C ' ' A' ' 51' ' ' LEU . 6.6 tt -67.78 -51.79 44.78 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.271 -0.893 . . . . 0.0 109.525 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.678 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -65.11 -42.74 93.7 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.163 -0.96 . . . . 0.0 109.511 179.885 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 80.3 mmt-85 -62.48 -37.89 87.71 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.269 -0.894 . . . . 0.0 109.521 -179.56 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 33.2 t80 -59.75 -51.66 68.8 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.313 -0.867 . . . . 0.0 109.445 -179.57 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.427 ' C ' ' N ' ' A' ' 57' ' ' GLY . 79.0 mt -100.3 5.63 44.54 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.24 -0.913 . . . . 0.0 109.517 179.683 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.678 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -52.72 -10.94 1.11 Allowed Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 -179.202 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLY . . . . . 0.427 ' N ' ' C ' ' A' ' 55' ' ' LEU . . . -106.22 -50.12 0.89 Allowed Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.556 -1.417 . . . . 0.0 109.556 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 95.1 p -63.64 -24.25 67.71 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.288 -1.125 . . . . 0.0 109.531 -179.544 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 2.1 mmm -169.77 163.42 9.83 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.23 -0.919 . . . . 0.0 109.405 -179.709 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 49.7 t0 -95.37 114.89 26.71 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.222 -0.924 . . . . 0.0 109.465 179.636 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 95.2 mt -110.61 7.05 22.25 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.227 -0.921 . . . . 0.0 109.467 -179.408 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 33.4 t -51.93 -32.05 31.38 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.2 -0.938 . . . . 0.0 109.437 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 24.2 p -91.99 14.31 16.15 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.238 -0.914 . . . . 0.0 109.452 -179.499 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.525 ' O ' ' NZ ' ' A' ' 48' ' ' LYS . 84.0 t80 -89.7 123.56 33.83 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.248 -0.908 . . . . 0.0 109.44 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 82.4 m-20 -78.59 124.19 27.9 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.325 -0.86 . . . . 0.0 109.448 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.562 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 77.5 t80 -77.45 -43.18 33.28 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.293 -0.879 . . . . 0.0 109.486 179.445 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.22 -45.39 94.77 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.286 -0.884 . . . . 0.0 109.459 -178.923 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 76.0 p -92.49 -17.85 23.96 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.274 -0.891 . . . . 0.0 109.5 -179.089 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 62.85 28.59 72.07 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.504 -1.438 . . . . 0.0 109.504 -179.684 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 64.4 mttp -125.25 153.49 43.11 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.324 -1.103 . . . . 0.0 109.44 -179.436 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.419 ' HB2' ' HB2' ' A' ' 12' ' ' ALA . 24.7 ttm -90.65 126.43 35.97 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.272 -0.893 . . . . 0.0 109.514 -179.745 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.444 HD23 ' C ' ' A' ' 72' ' ' LEU . 1.6 tt . . . . . 0 N--CA 1.489 1.517 0 O-C-N 121.171 -0.956 . . . . 0.0 109.527 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.6 ' C ' ' H ' ' A' ' 3' ' ' MET . . . . . . . . 1 N--CA 1.529 4.866 0 N-CA-C 119.353 2.501 . . . . 0.0 119.353 . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.1 t 67.16 -29.06 0.14 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.242 -1.152 . . . . 0.0 109.531 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.6 ' H ' ' C ' ' A' ' 1' ' ' GLY . 99.3 mmm -81.34 117.55 21.9 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.208 -0.932 . . . . 0.0 109.362 -179.9 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.602 ' N ' ' OE1' ' A' ' 4' ' ' GLU . 55.8 mp0 -94.11 17.84 11.81 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.293 -0.879 . . . . 0.0 109.47 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.449 ' NE ' ' OE2' ' A' ' 20' ' ' GLU . 79.3 mtp180 -88.41 111.85 22.24 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.278 -0.889 . . . . 0.0 109.421 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.457 ' HB3' ' CH2' ' A' ' 8' ' ' TRP . 59.8 mttt -82.9 168.83 16.69 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.183 -0.948 . . . . 0.0 109.472 -179.303 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.426 ' HG2' ' O ' ' A' ' 6' ' ' LYS . 22.7 mmt180 -146.57 138.01 24.45 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.154 -0.967 . . . . 0.0 109.455 -178.179 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.468 ' HE1' ' HB2' ' A' ' 21' ' ' GLU . 12.4 m95 -123.61 118.16 26.68 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.228 -0.92 . . . . 0.0 109.489 179.088 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 -78.41 148.83 33.47 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.22 -0.925 . . . . 0.0 109.518 178.554 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.536 ' SG ' ' NE ' ' A' ' 19' ' ' ARG . 20.8 p -135.13 101.5 11.29 Favored Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.155 -0.966 . . . . 0.0 109.494 -179.278 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -73.54 -11.44 24.36 Favored 'Trans proline' 0 C--N 1.305 -1.761 0 C-N-CA 122.836 2.358 . . . . 0.0 112.224 179.227 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.513 ' C ' HD22 ' A' ' 13' ' ' LEU . . . -80.21 -21.14 43.23 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.221 -0.924 . . . . 0.0 109.409 178.938 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.566 HD22 ' N ' ' A' ' 13' ' ' LEU . 3.3 mm? -98.94 156.78 35.13 Favored Pre-proline 0 N--CA 1.489 1.499 0 O-C-N 121.198 -0.939 . . . . 0.0 109.43 179.544 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -52.79 147.51 31.68 Favored 'Trans proline' 0 C--N 1.305 -1.736 0 C-N-CA 122.838 2.359 . . . . 0.0 112.263 178.867 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 27.3 mm100 -56.64 125.47 22.39 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.232 -0.917 . . . . 0.0 109.507 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 124.54 -18.9 7.18 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.57 -1.412 . . . . 0.0 109.57 179.732 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' TRP . . . . . 0.406 ' HB3' HH21 ' A' ' 19' ' ' ARG . 47.9 m95 -91.21 137.35 32.43 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.237 -1.154 . . . . 0.0 109.441 179.319 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -146.58 162.35 38.57 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.236 -0.915 . . . . 0.0 109.485 -179.151 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.536 ' NE ' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -123.04 160.24 26.73 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.274 -0.892 . . . . 0.0 109.473 178.812 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.449 ' OE2' ' NE ' ' A' ' 5' ' ' ARG . 75.6 tt0 -145.11 134.82 23.45 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.29 -0.881 . . . . 0.0 109.464 -179.082 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.533 ' CD ' HG22 ' A' ' 35' ' ' VAL . 4.0 tp10 -103.95 129.97 51.54 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.21 -0.931 . . . . 0.0 109.35 178.191 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.0 t -134.12 99.21 13.68 Favored Pre-proline 0 N--CA 1.489 1.476 0 O-C-N 121.271 -0.893 . . . . 0.0 109.593 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -58.03 135.19 67.08 Favored 'Trans proline' 0 C--N 1.304 -1.796 0 C-N-CA 122.858 2.372 . . . . 0.0 112.122 178.105 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.427 HH11 ' HD2' ' A' ' 24' ' ' ARG . 20.8 ttm105 -66.72 147.95 52.57 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.231 -0.918 . . . . 0.0 109.464 179.619 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -144.53 -31.44 0.44 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.239 -0.913 . . . . 0.0 109.46 -179.101 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 66.7 m -121.58 -3.05 9.33 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.259 -0.901 . . . . 0.0 109.403 -179.54 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -74.7 154.6 47.27 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 -179.798 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.433 ' C ' ' H ' ' A' ' 30' ' ' ALA . 56.9 tp -61.73 -40.25 94.43 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.303 -1.116 . . . . 0.0 109.457 179.763 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.553 ' O ' ' C ' ' A' ' 30' ' ' ALA . 4.0 t -77.27 26.33 0.16 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.229 -0.92 . . . . 0.0 109.436 -179.445 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.553 ' C ' ' O ' ' A' ' 29' ' ' SER . . . -33.01 150.71 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.277 -0.889 . . . . 0.0 109.443 179.542 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 104.84 -40.5 2.45 Favored Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 -179.461 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 71.0 m80 -90.62 158.57 16.88 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.241 -1.152 . . . . 0.0 109.447 179.764 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 37.2 ptt-85 -117.26 138.86 51.45 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.343 -0.848 . . . . 0.0 109.481 179.759 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -100.68 138.45 37.72 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.243 -0.911 . . . . 0.0 109.452 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.533 HG22 ' CD ' ' A' ' 21' ' ' GLU . 37.6 t -110.04 134.62 51.6 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.304 -0.872 . . . . 0.0 109.437 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -119.55 145.06 46.7 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.289 -0.882 . . . . 0.0 109.478 179.586 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.689 ' CE1' ' CZ ' ' A' ' 66' ' ' PHE . 7.7 m-85 -114.84 145.27 42.34 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.267 -0.895 . . . . 0.0 109.4 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -123.68 135.52 53.94 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.34 -0.85 . . . . 0.0 109.608 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.457 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -98.21 177.96 1.46 Allowed Pre-proline 0 N--CA 1.49 1.533 0 O-C-N 121.28 -0.888 . . . . 0.0 109.467 179.325 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.457 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 50.0 Cg_exo -55.08 -32.95 81.83 Favored 'Trans proline' 0 C--N 1.305 -1.731 0 C-N-CA 122.82 2.347 . . . . 0.0 112.339 179.862 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 41.1 t -87.52 4.35 43.87 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.341 -0.849 . . . . 0.0 109.494 -179.773 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 82.09 16.15 72.86 Favored Glycine 0 N--CA 1.489 2.175 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 -179.743 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -70.25 119.62 14.71 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.29 -1.123 . . . . 0.0 109.509 179.823 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.443 ' O ' ' HG3' ' A' ' 44' ' ' LYS . 24.3 pttm -94.8 125.03 39.19 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.235 -0.916 . . . . 0.0 109.494 178.873 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 31.8 p90 -141.48 149.04 40.4 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.214 -0.929 . . . . 0.0 109.557 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 26.5 ptt-85 -133.91 60.78 1.69 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.178 -0.951 . . . . 0.0 109.439 179.847 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.2 m -155.62 138.83 15.63 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.243 -0.911 . . . . 0.0 109.469 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.606 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 2.3 tttm -65.9 -45.8 64.65 Favored Pre-proline 0 N--CA 1.49 1.536 0 O-C-N 121.245 -0.909 . . . . 0.0 109.41 -179.719 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.606 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 49.0 Cg_exo -54.97 -44.4 50.13 Favored 'Trans proline' 0 C--N 1.306 -1.679 0 C-N-CA 122.84 2.36 . . . . 0.0 112.228 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -67.78 -38.15 83.0 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.236 -0.915 . . . . 0.0 109.444 179.816 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 55.3 tp -65.87 -45.8 80.77 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.31 -0.869 . . . . 0.0 109.397 -179.329 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.707 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -69.02 -44.56 72.48 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.302 -0.874 . . . . 0.0 109.529 -179.648 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 7.9 tpt180 -60.22 -43.3 96.13 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.267 -0.896 . . . . 0.0 109.456 -179.474 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 25.9 t80 -62.64 -52.86 61.68 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.181 -0.95 . . . . 0.0 109.451 -179.301 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.406 HD23 ' HA ' ' A' ' 55' ' ' LEU . 97.6 mt -90.9 2.53 56.12 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.271 -0.893 . . . . 0.0 109.464 179.78 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.707 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -45.06 -78.13 0.08 OUTLIER Glycine 0 N--CA 1.491 2.359 0 N-CA-C 109.471 -1.452 . . . . 0.0 109.471 -179.913 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.32 7.47 0.22 Allowed Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 -179.564 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.563 ' H ' ' C ' ' A' ' 56' ' ' GLY . 3.0 m -104.19 -27.03 12.29 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.228 -1.16 . . . . 0.0 109.533 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.671 ' SD ' HD11 ' A' ' 61' ' ' LEU . 1.7 ptp 178.1 171.25 0.7 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.253 -0.905 . . . . 0.0 109.48 -179.463 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 59.6 t0 -93.56 111.44 23.11 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.194 -0.942 . . . . 0.0 109.397 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.671 HD11 ' SD ' ' A' ' 59' ' ' MET . 10.7 mp -99.73 5.1 45.71 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.239 -0.913 . . . . 0.0 109.428 -179.921 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 23.4 m -46.16 -38.78 8.68 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.279 -0.888 . . . . 0.0 109.462 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 55.8 p -95.35 49.65 1.21 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.301 -0.874 . . . . 0.0 109.4 179.315 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 65.9 t80 -116.61 132.16 56.76 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.302 -0.874 . . . . 0.0 109.477 -179.576 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 91.8 m-20 -93.42 107.75 19.53 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.188 -0.945 . . . . 0.0 109.544 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.689 ' CZ ' ' CE1' ' A' ' 37' ' ' TYR . 53.2 t80 -75.43 -40.36 57.78 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.339 -0.851 . . . . 0.0 109.465 -179.723 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 27.9 mmt180 -62.05 -32.89 73.45 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.282 -0.886 . . . . 0.0 109.464 -179.592 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 16.1 p -95.22 -15.23 23.4 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.258 -0.901 . . . . 0.0 109.486 -179.389 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 67.12 27.02 73.34 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.579 -1.408 . . . . 0.0 109.579 -179.608 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -138.19 158.0 45.17 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.198 -1.178 . . . . 0.0 109.47 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.427 ' O ' ' C ' ' A' ' 72' ' ' LEU . 19.9 ttm -91.35 132.76 35.97 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.192 -0.942 . . . . 0.0 109.543 -179.763 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.427 ' C ' ' O ' ' A' ' 71' ' ' MET . 56.1 tp . . . . . 0 N--CA 1.49 1.567 0 O-C-N 121.281 -0.887 . . . . 0.0 109.528 -179.532 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.528 4.832 0 N-CA-C 119.431 2.532 . . . . 0.0 119.431 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 41.6 t -107.6 153.07 23.42 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.318 -1.107 . . . . 0.0 109.479 -179.775 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 57.1 mtt 53.82 39.85 30.83 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.233 -0.917 . . . . 0.0 109.41 179.844 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 76.9 mm-40 -98.48 115.14 27.91 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.325 -0.859 . . . . 0.0 109.464 179.517 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 84.0 mtt85 -127.22 132.14 50.49 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.175 -0.953 . . . . 0.0 109.512 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.421 ' HB2' ' CZ3' ' A' ' 8' ' ' TRP . 26.1 mmtp -100.32 98.04 8.74 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.159 -0.963 . . . . 0.0 109.532 179.786 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.597 HH21 ' CD ' ' A' ' 18' ' ' GLU . 85.2 mtp180 -70.66 166.2 21.28 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.173 -0.954 . . . . 0.0 109.465 -179.405 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.491 ' CG ' ' O ' ' A' ' 7' ' ' ARG . 1.3 m0 -165.8 141.9 5.15 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.235 -0.916 . . . . 0.0 109.542 -179.474 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -111.29 139.59 46.56 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.247 -0.908 . . . . 0.0 109.493 179.256 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.7 t -127.58 140.6 38.49 Favored Pre-proline 0 N--CA 1.49 1.567 0 O-C-N 121.247 -0.908 . . . . 0.0 109.505 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -51.11 -31.79 37.05 Favored 'Trans proline' 0 C--N 1.305 -1.756 0 C-N-CA 122.812 2.342 . . . . 0.0 112.157 179.333 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.407 ' HB2' ' HB2' ' A' ' 71' ' ' MET . . . -76.89 -10.73 59.57 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.164 -0.96 . . . . 0.0 109.462 -179.492 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.6 mp -90.43 116.17 65.79 Favored Pre-proline 0 N--CA 1.49 1.567 0 O-C-N 121.243 -0.911 . . . . 0.0 109.495 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.415 ' O ' ' C ' ' A' ' 15' ' ' GLN . 48.6 Cg_exo -51.04 141.93 35.98 Favored 'Trans proline' 0 C--N 1.305 -1.725 0 C-N-CA 122.832 2.355 . . . . 0.0 112.244 -179.551 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.415 ' C ' ' O ' ' A' ' 14' ' ' PRO . 0.0 OUTLIER -44.64 107.17 0.09 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.249 -0.907 . . . . 0.0 109.523 -179.498 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 127.13 -23.87 5.45 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 178.725 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 24.1 m95 -80.04 139.13 37.07 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.215 -1.168 . . . . 0.0 109.46 178.748 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.597 ' CD ' HH21 ' A' ' 7' ' ' ARG . 97.0 mt-10 -127.95 150.47 49.88 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.248 -0.908 . . . . 0.0 109.432 -178.089 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.402 ' NH1' ' HA3' ' A' ' 69' ' ' GLY . 53.8 ttp180 -128.16 149.89 50.24 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.219 -0.926 . . . . 0.0 109.493 177.807 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 18.8 pt-20 -156.07 141.02 17.25 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.288 -0.883 . . . . 0.0 109.496 -179.226 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 79.6 tt0 -98.49 133.04 43.41 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.229 -0.919 . . . . 0.0 109.352 178.458 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.6 t -139.78 103.46 6.95 Favored Pre-proline 0 N--CA 1.49 1.559 0 O-C-N 121.182 -0.948 . . . . 0.0 109.533 -178.83 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' PRO . . . . . 0.416 ' HA ' ' HA ' ' A' ' 33' ' ' ARG . 47.1 Cg_exo -55.38 129.34 34.67 Favored 'Trans proline' 0 C--N 1.305 -1.715 0 C-N-CA 122.881 2.387 . . . . 0.0 112.203 178.685 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -59.26 141.18 54.99 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.203 -0.936 . . . . 0.0 109.476 179.716 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.572 ' O ' ' O ' ' A' ' 26' ' ' SER . 27.1 mmt180 -121.53 5.34 10.11 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.286 -0.884 . . . . 0.0 109.462 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.572 ' O ' ' O ' ' A' ' 25' ' ' ARG . 47.5 t -34.41 -94.54 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.347 -0.846 . . . . 0.0 109.467 -179.591 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -155.67 -92.53 0.09 OUTLIER Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.525 -1.43 . . . . 0.0 109.525 -179.787 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.4 tt -65.67 -44.1 87.29 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.287 -1.125 . . . . 0.0 109.436 -179.532 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.497 ' O ' ' C ' ' A' ' 30' ' ' ALA . 6.2 m -74.16 -20.64 60.16 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.286 -0.884 . . . . 0.0 109.578 -179.886 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.497 ' C ' ' O ' ' A' ' 29' ' ' SER . . . -39.07 132.58 1.3 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.281 -0.887 . . . . 0.0 109.394 179.518 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 123.88 -41.03 1.82 Allowed Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.531 -1.428 . . . . 0.0 109.531 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 52.8 m-70 -57.29 102.1 0.08 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.205 -1.174 . . . . 0.0 109.447 179.596 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.416 ' HA ' ' HA ' ' A' ' 23' ' ' PRO . 99.6 mtt180 -53.67 132.39 40.76 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.229 -0.919 . . . . 0.0 109.458 179.555 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.607 ' OD1' ' N ' ' A' ' 35' ' ' VAL . 66.8 t0 -125.64 149.37 48.48 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.34 -0.85 . . . . 0.0 109.433 179.493 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.607 ' N ' ' OD1' ' A' ' 34' ' ' ASP . 64.0 t -117.06 133.75 62.82 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 O-C-N 121.247 -0.908 . . . . 0.0 109.469 -179.113 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.406 ' CZ ' ' OD2' ' A' ' 34' ' ' ASP . 96.7 m-85 -122.56 146.05 47.77 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.287 -0.883 . . . . 0.0 109.468 179.19 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.462 ' HB2' ' CE2' ' A' ' 45' ' ' PHE . 41.5 m-85 -116.07 151.34 35.74 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.262 -0.899 . . . . 0.0 109.501 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 67.5 m-85 -126.07 136.77 53.32 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.324 -0.86 . . . . 0.0 109.508 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.477 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.4 OUTLIER -98.05 178.98 1.17 Allowed Pre-proline 0 N--CA 1.49 1.547 0 O-C-N 121.285 -0.884 . . . . 0.0 109.433 179.695 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.477 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 43.0 Cg_exo -55.67 -30.21 74.35 Favored 'Trans proline' 0 C--N 1.304 -1.802 0 C-N-CA 122.779 2.32 . . . . 0.0 112.212 -179.831 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 99.8 p -87.37 4.07 44.52 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.225 -0.922 . . . . 0.0 109.488 -179.567 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 77.61 17.09 79.43 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.557 -1.417 . . . . 0.0 109.557 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.25 125.52 29.58 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.276 -1.132 . . . . 0.0 109.493 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 24.8 pttm -92.29 135.52 33.95 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.3 -0.875 . . . . 0.0 109.475 179.784 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.588 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 1.3 p90 -140.34 146.92 39.09 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.262 -0.899 . . . . 0.0 109.416 179.714 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 19.0 ttm180 -131.56 59.36 1.7 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.241 -0.912 . . . . 0.0 109.548 179.296 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -160.92 141.65 11.47 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.234 -0.916 . . . . 0.0 109.421 -179.725 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.735 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 16.9 tptm -69.92 -37.92 8.5 Favored Pre-proline 0 N--CA 1.49 1.574 0 O-C-N 121.291 -0.881 . . . . 0.0 109.474 -179.291 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.735 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 33.6 Cg_exo -61.21 -51.24 4.68 Favored 'Trans proline' 0 C--N 1.305 -1.728 0 C-N-CA 122.866 2.378 . . . . 0.0 112.224 179.554 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -64.77 -34.9 79.42 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.257 -0.902 . . . . 0.0 109.463 179.465 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.542 ' O ' HD23 ' A' ' 51' ' ' LEU . 5.6 tt -62.44 -48.36 80.0 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.242 -0.911 . . . . 0.0 109.405 -179.759 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -69.91 -42.62 73.11 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.267 -0.896 . . . . 0.0 109.438 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 61.5 ttp180 -59.05 -41.37 87.76 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.389 -0.819 . . . . 0.0 109.539 179.453 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 50.4 t80 -60.0 -54.49 45.4 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.218 -0.926 . . . . 0.0 109.454 -179.666 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.511 HD12 HD22 ' A' ' 61' ' ' LEU . 36.3 mt -63.62 -42.07 98.22 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.199 -0.938 . . . . 0.0 109.473 179.821 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 72.73 -139.76 27.97 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -84.86 -0.1 89.11 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 78.0 p -66.43 -32.84 74.47 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.216 -1.167 . . . . 0.0 109.429 -179.744 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 44.4 mmm -144.42 135.78 25.5 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.213 -0.929 . . . . 0.0 109.469 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.578 ' C ' HD12 ' A' ' 61' ' ' LEU . 39.7 p-10 -93.13 112.3 24.2 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.231 -0.918 . . . . 0.0 109.551 179.326 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.578 HD12 ' C ' ' A' ' 60' ' ' ASP . 9.7 mp -117.67 14.14 14.36 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.153 -0.967 . . . . 0.0 109.507 -179.246 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 83.3 p -49.38 -34.82 17.09 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.201 -0.937 . . . . 0.0 109.49 179.784 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 40.3 p -100.33 36.06 1.96 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.234 -0.916 . . . . 0.0 109.435 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 80.2 t80 -105.71 129.14 53.99 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.274 -0.891 . . . . 0.0 109.497 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 55.1 t0 -86.68 118.77 26.3 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.3 -0.875 . . . . 0.0 109.456 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 65.3 t80 -81.44 -37.57 27.84 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.245 -0.909 . . . . 0.0 109.463 -179.519 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.416 HH11 ' HD3' ' A' ' 67' ' ' ARG . 24.4 mmt180 -63.95 -43.32 96.19 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.201 -0.937 . . . . 0.0 109.483 -179.054 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 71.1 p -95.61 -19.74 19.52 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.294 -0.879 . . . . 0.0 109.483 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.402 ' HA3' ' NH1' ' A' ' 19' ' ' ARG . . . 67.57 53.14 26.0 Favored Glycine 0 N--CA 1.489 2.232 0 N-CA-C 109.549 -1.421 . . . . 0.0 109.549 178.943 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 19.8 ptmt -150.3 151.77 33.46 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.199 -1.177 . . . . 0.0 109.433 179.303 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.407 ' HB2' ' HB2' ' A' ' 12' ' ' ALA . 38.1 ttm -95.22 124.81 39.45 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.22 -0.925 . . . . 0.0 109.494 -179.738 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 60.5 tp . . . . . 0 N--CA 1.49 1.553 0 O-C-N 121.262 -0.899 . . . . 0.0 109.472 -179.603 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.528 4.833 0 N-CA-C 119.361 2.504 . . . . 0.0 119.361 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 58.5 m -65.9 -72.46 0.16 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.268 -1.136 . . . . 0.0 109.464 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 77.7 mtm -92.4 120.16 32.63 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.237 -0.914 . . . . 0.0 109.429 179.81 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -105.71 167.45 9.76 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.308 -0.87 . . . . 0.0 109.484 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 66.7 ttp85 60.13 105.53 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.219 -0.926 . . . . 0.0 109.475 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 40.1 mttt -103.54 107.7 18.65 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.176 -0.952 . . . . 0.0 109.442 -179.861 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 3.4 ptp180 -70.07 167.01 18.57 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.241 -0.912 . . . . 0.0 109.487 -179.466 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.849 ' HE1' ' H ' ' A' ' 21' ' ' GLU . 60.9 m95 -143.33 129.42 19.69 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.246 -0.909 . . . . 0.0 109.499 179.827 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -58.06 139.12 55.28 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.25 -0.907 . . . . 0.0 109.546 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -71.16 126.92 91.98 Favored Pre-proline 0 N--CA 1.491 1.589 0 O-C-N 121.237 -0.915 . . . . 0.0 109.456 -179.717 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -74.06 -59.72 0.05 OUTLIER 'Trans proline' 0 C--N 1.303 -1.818 0 C-N-CA 122.823 2.348 . . . . 0.0 112.198 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.489 ' CB ' ' SD ' ' A' ' 71' ' ' MET . . . -116.28 -28.95 6.37 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.325 -0.859 . . . . 0.0 109.476 179.322 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.462 ' C ' ' O ' ' A' ' 12' ' ' ALA . 5.3 mp -40.7 157.49 0.18 Allowed Pre-proline 0 N--CA 1.491 1.608 0 O-C-N 121.177 -0.952 . . . . 0.0 109.462 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.501 ' HG2' ' CD1' ' A' ' 17' ' ' TRP . 34.0 Cg_endo -66.29 151.69 82.8 Favored 'Trans proline' 0 C--N 1.305 -1.746 0 C-N-CA 122.836 2.358 . . . . 0.0 112.205 179.042 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -58.58 123.45 16.31 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.268 -0.895 . . . . 0.0 109.498 -178.518 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 125.69 -27.14 5.26 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.489 -1.444 . . . . 0.0 109.489 178.419 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' TRP . . . . . 0.51 ' CZ2' HD21 ' A' ' 55' ' ' LEU . 15.5 m95 -84.78 143.23 29.25 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.235 -1.156 . . . . 0.0 109.441 179.585 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 75.1 tt0 -136.13 151.85 50.2 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.261 -0.899 . . . . 0.0 109.544 -178.838 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.494 HH11 ' HD2' ' A' ' 19' ' ' ARG . 26.5 mtm105 -121.88 163.25 19.55 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.242 -0.911 . . . . 0.0 109.445 178.373 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -155.78 128.53 7.92 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.214 -0.929 . . . . 0.0 109.492 -179.513 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.849 ' H ' ' HE1' ' A' ' 8' ' ' TRP . 92.0 mt-10 -89.8 134.19 34.32 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.278 -0.889 . . . . 0.0 109.324 178.858 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.524 ' O ' ' OD1' ' A' ' 34' ' ' ASP . 25.5 t -137.25 100.43 9.49 Favored Pre-proline 0 N--CA 1.49 1.557 0 O-C-N 121.225 -0.922 . . . . 0.0 109.61 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_exo -54.6 131.35 45.18 Favored 'Trans proline' 0 C--N 1.304 -1.789 0 C-N-CA 122.822 2.348 . . . . 0.0 112.207 179.001 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.477 HH12 ' HB2' ' A' ' 29' ' ' SER . 84.4 mtp180 -74.49 159.39 32.32 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.206 -0.934 . . . . 0.0 109.53 179.602 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 65.5 ttt180 -167.27 19.18 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.277 -0.89 . . . . 0.0 109.54 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -149.37 -43.4 0.14 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.369 -0.832 . . . . 0.0 109.543 -179.688 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.405 ' HA3' HH21 ' A' ' 24' ' ' ARG . . . -50.93 155.93 2.99 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 -179.816 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 57.3 tp -62.32 -41.36 98.49 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.319 -1.106 . . . . 0.0 109.481 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.539 ' O ' ' O ' ' A' ' 30' ' ' ALA . 73.4 m -83.03 13.2 4.18 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.261 -0.9 . . . . 0.0 109.451 -179.732 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.539 ' O ' ' O ' ' A' ' 29' ' ' SER . . . -42.39 169.68 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.273 -0.892 . . . . 0.0 109.475 179.709 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 113.73 -26.52 10.0 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.519 -1.433 . . . . 0.0 109.519 -179.481 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 30.3 m170 -107.88 -179.96 4.05 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.261 -1.141 . . . . 0.0 109.474 179.83 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -113.24 133.15 55.23 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.274 -0.891 . . . . 0.0 109.556 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.524 ' OD1' ' O ' ' A' ' 22' ' ' VAL . 7.5 p30 -104.25 136.65 43.46 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.352 -0.843 . . . . 0.0 109.484 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.402 HG22 ' HG2' ' A' ' 21' ' ' GLU . 38.9 t -110.79 134.78 51.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.358 -0.839 . . . . 0.0 109.477 179.317 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -114.36 149.49 36.02 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.294 -0.878 . . . . 0.0 109.516 -179.616 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.563 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 17.1 m-85 -118.83 149.82 40.88 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.197 -0.939 . . . . 0.0 109.467 179.515 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.436 ' CD1' ' N ' ' A' ' 38' ' ' TYR . 15.0 m-85 -129.86 140.3 51.02 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.184 -0.947 . . . . 0.0 109.616 -179.696 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.43 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -109.74 176.94 1.36 Allowed Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.266 -0.896 . . . . 0.0 109.403 179.665 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.43 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 52.2 Cg_exo -53.26 -33.27 64.53 Favored 'Trans proline' 0 C--N 1.305 -1.741 0 C-N-CA 122.872 2.382 . . . . 0.0 112.246 179.551 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 20.9 t -76.41 -5.28 46.65 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.255 -0.903 . . . . 0.0 109.475 179.603 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 80.28 15.04 79.4 Favored Glycine 0 N--CA 1.489 2.206 0 N-CA-C 109.496 -1.442 . . . . 0.0 109.496 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -78.24 124.86 28.56 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.273 -1.134 . . . . 0.0 109.461 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.8 ptmm? -95.16 121.6 36.97 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.256 -0.903 . . . . 0.0 109.586 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -142.71 155.04 44.83 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.268 -0.895 . . . . 0.0 109.477 178.852 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.72 ' O ' ' C ' ' A' ' 47' ' ' SER . 5.0 ptt180 -130.77 -66.71 0.75 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.271 -0.893 . . . . 0.0 109.491 179.16 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.72 ' C ' ' O ' ' A' ' 46' ' ' ARG . 1.7 m -15.82 125.91 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.337 -0.852 . . . . 0.0 109.559 179.226 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.621 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 5.1 tmtp? -59.58 -45.56 98.7 Favored Pre-proline 0 N--CA 1.491 1.617 0 O-C-N 121.296 -0.877 . . . . 0.0 109.408 -179.646 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.621 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 52.5 Cg_exo -53.85 -46.08 36.28 Favored 'Trans proline' 0 C--N 1.305 -1.755 0 C-N-CA 122.837 2.358 . . . . 0.0 112.208 -179.42 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -66.41 -35.74 81.08 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.281 -0.887 . . . . 0.0 109.536 179.347 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 62.3 tp -63.04 -45.32 92.85 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.279 -0.888 . . . . 0.0 109.477 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.627 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -67.27 -40.58 86.18 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.174 -0.954 . . . . 0.0 109.472 -179.5 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 82.6 mtp180 -60.88 -42.14 97.37 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.331 -0.855 . . . . 0.0 109.517 -179.424 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 24.5 t80 -60.99 -53.83 52.45 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.189 -0.944 . . . . 0.0 109.464 -179.713 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.521 ' O ' ' N ' ' A' ' 57' ' ' GLY . 93.2 mt -88.13 1.89 53.3 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.29 -0.881 . . . . 0.0 109.504 179.356 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.627 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -44.67 94.69 0.01 OUTLIER Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.46 -1.456 . . . . 0.0 109.46 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLY . . . . . 0.521 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . 125.05 -52.33 0.8 Allowed Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.465 -1.454 . . . . 0.0 109.465 179.837 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.1 m -63.0 -34.6 77.89 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.213 -1.169 . . . . 0.0 109.454 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 51.6 ttp -163.98 157.81 18.92 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.251 -0.906 . . . . 0.0 109.465 -179.576 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.403 ' C ' HD22 ' A' ' 61' ' ' LEU . 51.4 t0 -89.38 110.26 21.09 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.252 -0.905 . . . . 0.0 109.512 -179.688 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.534 HD22 ' N ' ' A' ' 61' ' ' LEU . 4.0 mm? -93.78 -3.76 51.51 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.267 -0.896 . . . . 0.0 109.469 -179.733 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 38.4 t -59.45 -39.49 83.77 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.216 -0.927 . . . . 0.0 109.395 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 65.9 p -86.71 14.55 6.87 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.182 -0.949 . . . . 0.0 109.424 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -91.55 129.64 37.5 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.177 -0.952 . . . . 0.0 109.462 -179.836 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.52 ' O ' ' N ' ' A' ' 69' ' ' GLY . 60.9 t0 -80.03 112.19 17.1 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.196 -0.94 . . . . 0.0 109.472 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.563 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 48.2 t80 -75.13 -44.15 48.59 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.233 -0.917 . . . . 0.0 109.468 -179.006 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.418 ' HD2' ' N ' ' A' ' 67' ' ' ARG . 10.9 mpt_? -60.34 -42.52 95.88 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.198 -0.939 . . . . 0.0 109.518 -178.794 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.482 ' OG1' ' CG ' ' A' ' 65' ' ' ASP . 30.0 p -97.83 -13.85 21.08 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.302 -0.874 . . . . 0.0 109.497 -179.459 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.52 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 63.25 39.47 97.92 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.481 -1.448 . . . . 0.0 109.481 -179.841 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.438 ' H ' ' HB3' ' A' ' 65' ' ' ASP . 51.4 mttp -137.35 156.55 48.09 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.223 -1.163 . . . . 0.0 109.461 -179.487 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.489 ' SD ' ' CB ' ' A' ' 12' ' ' ALA . 37.2 mtt -84.95 148.47 26.2 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.199 -0.938 . . . . 0.0 109.442 -180.0 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 56.0 tp . . . . . 0 N--CA 1.49 1.546 0 O-C-N 121.282 -0.886 . . . . 0.0 109.446 179.967 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.499 ' O ' ' O ' ' A' ' 2' ' ' SER . . . . . . . . 1 N--CA 1.529 4.834 0 N-CA-C 119.378 2.511 . . . . 0.0 119.378 . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.499 ' O ' ' O ' ' A' ' 1' ' ' GLY . 1.4 t 51.33 103.31 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.255 -1.144 . . . . 0.0 109.537 -179.602 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -79.42 116.55 19.72 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.331 -0.856 . . . . 0.0 109.416 -179.873 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -142.99 -157.52 0.78 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.304 -0.872 . . . . 0.0 109.472 179.593 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 35.3 ptt180 -76.95 142.39 40.05 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.331 -0.855 . . . . 0.0 109.47 179.815 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.437 ' N ' ' HD3' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -114.39 113.09 24.05 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.244 -0.91 . . . . 0.0 109.442 179.883 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.52 ' NH2' ' OE1' ' A' ' 18' ' ' GLU . 69.4 mtp85 -72.01 168.06 18.84 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.273 -0.892 . . . . 0.0 109.38 -179.932 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.59 ' N ' ' O ' ' A' ' 19' ' ' ARG . 53.0 m95 -136.28 124.7 23.42 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.197 -0.939 . . . . 0.0 109.427 -179.418 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.521 ' N ' ' OE1' ' A' ' 9' ' ' GLU . 58.5 mp0 -90.78 117.07 29.12 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.279 -0.888 . . . . 0.0 109.398 179.769 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.419 ' SG ' ' HB3' ' A' ' 12' ' ' ALA . 46.4 t -119.24 100.32 50.15 Favored Pre-proline 0 N--CA 1.491 1.608 0 O-C-N 121.34 -0.85 . . . . 0.0 109.522 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_exo -55.2 -25.44 46.38 Favored 'Trans proline' 0 C--N 1.305 -1.749 0 C-N-CA 122.945 2.43 . . . . 0.0 112.19 178.955 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.455 ' HB1' ' SD ' ' A' ' 71' ' ' MET . . . -57.45 -35.08 69.65 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.267 -0.895 . . . . 0.0 109.47 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.671 HD22 ' N ' ' A' ' 13' ' ' LEU . 3.2 mm? -89.97 154.9 47.64 Favored Pre-proline 0 N--CA 1.49 1.555 0 O-C-N 121.201 -0.937 . . . . 0.0 109.402 179.793 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_exo -52.1 146.7 29.4 Favored 'Trans proline' 0 C--N 1.306 -1.709 0 C-N-CA 122.78 2.32 . . . . 0.0 112.231 179.064 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 8.7 mp0 -55.29 124.08 15.89 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.252 -0.905 . . . . 0.0 109.509 -179.757 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 124.31 -22.47 6.64 Favored Glycine 0 N--CA 1.49 2.243 0 N-CA-C 109.647 -1.381 . . . . 0.0 109.647 179.427 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 52.4 m95 -85.36 136.16 33.59 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.177 -1.19 . . . . 0.0 109.473 179.205 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.52 ' OE1' ' NH2' ' A' ' 7' ' ' ARG . 72.4 mt-10 -142.41 155.7 45.14 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.326 -0.859 . . . . 0.0 109.424 -179.126 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.615 HH22 ' CD2' ' A' ' 13' ' ' LEU . 0.0 OUTLIER -138.56 140.24 38.97 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.211 -0.93 . . . . 0.0 109.399 178.953 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -132.89 142.59 49.0 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.241 -0.912 . . . . 0.0 109.481 -178.365 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.521 ' HG3' ' HE1' ' A' ' 8' ' ' TRP . 92.4 mt-10 -98.99 142.58 30.3 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.376 -0.827 . . . . 0.0 109.392 178.391 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 10.4 t -145.17 123.39 6.53 Favored Pre-proline 0 N--CA 1.491 1.598 0 O-C-N 121.219 -0.925 . . . . 0.0 109.611 -179.535 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -74.84 135.55 19.56 Favored 'Trans proline' 0 C--N 1.304 -1.813 0 C-N-CA 122.879 2.386 . . . . 0.0 112.214 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.438 HH21 ' HA3' ' A' ' 27' ' ' GLY . 78.3 mtp85 -78.24 166.21 22.99 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.273 -0.892 . . . . 0.0 109.484 179.652 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 57.5 ttp180 -170.33 -9.2 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.213 -0.93 . . . . 0.0 109.523 -179.425 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 15.9 t -126.84 -20.8 4.17 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.251 -0.906 . . . . 0.0 109.417 -179.918 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.438 ' HA3' HH21 ' A' ' 24' ' ' ARG . . . -73.36 165.83 54.73 Favored Glycine 0 N--CA 1.492 2.387 0 N-CA-C 109.549 -1.42 . . . . 0.0 109.549 -179.831 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.408 ' HA ' HD12 ' A' ' 28' ' ' LEU . 58.3 tp -62.54 -40.94 98.38 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.255 -1.144 . . . . 0.0 109.461 179.904 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.541 ' O ' ' C ' ' A' ' 30' ' ' ALA . 83.7 p -79.8 15.34 1.42 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.292 -0.88 . . . . 0.0 109.442 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.541 ' C ' ' O ' ' A' ' 29' ' ' SER . . . -35.89 152.82 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.21 -0.931 . . . . 0.0 109.475 179.804 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 102.9 -37.68 3.59 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.554 -1.418 . . . . 0.0 109.554 -179.625 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 33.2 m170 -85.39 168.44 14.62 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.356 -1.084 . . . . 0.0 109.455 179.555 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -114.98 128.04 56.04 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.245 -0.909 . . . . 0.0 109.518 -179.52 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 22.7 m-20 -106.92 137.42 45.01 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.211 -0.931 . . . . 0.0 109.419 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.426 HG22 ' HG2' ' A' ' 21' ' ' GLU . 3.0 t -106.91 135.03 46.83 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.246 -0.909 . . . . 0.0 109.411 179.577 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -113.7 141.54 47.11 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.313 -0.867 . . . . 0.0 109.524 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.709 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 17.5 m-85 -114.36 142.05 46.83 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.281 -0.887 . . . . 0.0 109.357 -179.352 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 86.2 m-85 -123.06 135.09 54.27 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.307 -0.871 . . . . 0.0 109.47 -179.607 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.454 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -97.2 177.56 1.63 Allowed Pre-proline 0 N--CA 1.491 1.592 0 O-C-N 121.191 -0.943 . . . . 0.0 109.426 179.593 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.454 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 47.4 Cg_exo -54.49 -31.37 68.78 Favored 'Trans proline' 0 C--N 1.304 -1.809 0 C-N-CA 122.848 2.365 . . . . 0.0 112.258 -179.656 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 71.8 m -88.62 7.08 35.21 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.316 -0.865 . . . . 0.0 109.476 179.561 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 79.95 10.7 85.33 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 -179.584 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -64.22 122.75 17.37 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.168 -1.195 . . . . 0.0 109.457 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 13.5 ptpt -95.88 126.88 41.44 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.242 -0.911 . . . . 0.0 109.525 178.9 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.634 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 1.1 p90 -139.92 146.46 39.24 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.296 -0.877 . . . . 0.0 109.47 -179.919 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 28.4 ptt-85 -134.79 53.59 1.98 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.3 -0.875 . . . . 0.0 109.549 179.213 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.4 p -159.41 144.71 15.77 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.285 -0.884 . . . . 0.0 109.563 -179.824 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.666 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 0.6 OUTLIER -69.39 -42.29 20.06 Favored Pre-proline 0 N--CA 1.49 1.545 0 O-C-N 121.211 -0.931 . . . . 0.0 109.4 -179.473 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.666 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 42.9 Cg_exo -57.54 -48.98 14.83 Favored 'Trans proline' 0 C--N 1.305 -1.752 0 C-N-CA 122.898 2.399 . . . . 0.0 112.231 -179.897 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -65.84 -38.07 87.89 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.275 -0.891 . . . . 0.0 109.388 179.54 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.516 HD13 ' CE2' ' A' ' 45' ' ' PHE . 37.0 tp -64.02 -45.41 89.02 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.274 -0.891 . . . . 0.0 109.493 -179.636 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.591 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -65.86 -43.98 86.77 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.262 -0.899 . . . . 0.0 109.425 -179.665 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 15.1 tpp180 -56.06 -42.88 77.33 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.251 -0.905 . . . . 0.0 109.448 -179.419 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 56.2 t80 -61.1 -52.14 66.17 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.207 -0.933 . . . . 0.0 109.387 -179.215 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.496 HD12 ' O ' ' A' ' 56' ' ' GLY . 2.5 pp -86.9 0.94 54.14 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.228 -0.92 . . . . 0.0 109.492 179.718 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.591 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . 44.17 -121.8 4.06 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 -179.743 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -110.01 31.71 7.27 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.595 -1.402 . . . . 0.0 109.595 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 38.2 t -87.82 -21.11 25.25 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.228 -1.16 . . . . 0.0 109.458 -179.579 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 63.8 mmm -139.07 130.39 26.93 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.173 -0.954 . . . . 0.0 109.454 -179.64 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 63.0 t0 -90.79 106.38 18.47 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.272 -0.893 . . . . 0.0 109.479 179.191 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.416 ' O ' ' C ' ' A' ' 62' ' ' SER . 98.6 mt -93.47 4.44 53.95 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.23 -0.919 . . . . 0.0 109.487 -179.308 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.416 ' C ' ' O ' ' A' ' 61' ' ' LEU . 39.7 t -42.9 -39.71 2.66 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.285 -0.884 . . . . 0.0 109.484 179.577 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 67.9 p -98.57 48.39 0.98 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.238 -0.914 . . . . 0.0 109.417 179.345 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -124.25 131.0 53.5 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.299 -0.875 . . . . 0.0 109.482 -179.499 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.459 ' CG ' ' OG1' ' A' ' 68' ' ' THR . 55.7 t0 -89.94 104.59 17.14 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.125 -0.984 . . . . 0.0 109.463 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.709 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 68.2 t80 -74.16 -49.34 24.04 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.195 -0.94 . . . . 0.0 109.501 -179.231 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 19.0 mmm180 -51.43 -37.6 49.45 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.171 -0.956 . . . . 0.0 109.449 -179.624 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.459 ' OG1' ' CG ' ' A' ' 65' ' ' ASP . 22.3 p -100.45 -11.21 20.38 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.265 -0.897 . . . . 0.0 109.481 -179.881 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 62.12 34.23 88.37 Favored Glycine 0 N--CA 1.491 2.361 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 179.768 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 62.0 mttp -127.86 147.38 50.45 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.215 -1.167 . . . . 0.0 109.475 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.455 ' SD ' ' HB1' ' A' ' 12' ' ' ALA . 3.6 tpt -77.87 140.26 39.32 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.184 -0.947 . . . . 0.0 109.513 179.774 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 60.4 tp . . . . . 0 N--CA 1.49 1.548 0 O-C-N 121.222 -0.924 . . . . 0.0 109.458 179.87 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.529 4.869 0 N-CA-C 119.449 2.54 . . . . 0.0 119.449 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.458 ' O ' ' C ' ' A' ' 3' ' ' MET . 22.3 t -65.53 146.5 54.78 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.277 -1.131 . . . . 0.0 109.474 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.458 ' C ' ' O ' ' A' ' 2' ' ' SER . 5.3 ttt 41.04 -157.83 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.217 -0.927 . . . . 0.0 109.454 -179.783 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.402 ' H ' ' HG2' ' A' ' 3' ' ' MET . 96.9 mt-10 -145.17 93.3 2.37 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.274 -0.891 . . . . 0.0 109.523 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 88.1 mtm180 -87.13 141.02 28.96 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.232 -0.917 . . . . 0.0 109.446 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.532 ' HB2' ' H ' ' A' ' 21' ' ' GLU . 11.3 mptt -76.06 139.97 41.67 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.365 -0.835 . . . . 0.0 109.521 179.742 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -157.44 92.3 1.22 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.265 -0.897 . . . . 0.0 109.508 -179.558 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.657 ' HE1' ' HE ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -122.27 149.22 44.01 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.19 -0.944 . . . . 0.0 109.509 179.304 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -62.7 150.83 40.04 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.276 -0.89 . . . . 0.0 109.505 179.655 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.448 ' SG ' ' C ' ' A' ' 18' ' ' GLU . 10.9 m -93.45 114.3 62.51 Favored Pre-proline 0 N--CA 1.492 1.644 0 O-C-N 121.251 -0.906 . . . . 0.0 109.517 -179.644 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -76.87 -39.4 0.65 Allowed 'Trans proline' 0 C--N 1.306 -1.689 0 C-N-CA 122.821 2.347 . . . . 0.0 112.233 179.389 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.406 ' C ' HD22 ' A' ' 13' ' ' LEU . . . -66.17 -36.39 82.98 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.211 -0.931 . . . . 0.0 109.554 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.702 HD22 ' N ' ' A' ' 13' ' ' LEU . 3.4 mm? -88.23 156.91 51.26 Favored Pre-proline 0 N--CA 1.49 1.555 0 O-C-N 121.17 -0.956 . . . . 0.0 109.452 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -52.2 142.79 44.61 Favored 'Trans proline' 0 C--N 1.306 -1.692 0 C-N-CA 122.802 2.334 . . . . 0.0 112.154 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 98.5 mm-40 -47.09 131.96 12.36 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.189 -0.944 . . . . 0.0 109.465 -179.832 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 120.61 -21.65 8.47 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 179.847 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' TRP . . . . . 0.413 ' CH2' HD11 ' A' ' 55' ' ' LEU . 18.1 m95 -84.47 147.89 26.84 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.133 -1.216 . . . . 0.0 109.473 179.688 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.448 ' C ' ' SG ' ' A' ' 10' ' ' CYS . 94.1 mt-10 -127.51 148.14 50.32 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.274 -0.891 . . . . 0.0 109.42 -178.679 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.657 ' HE ' ' HE1' ' A' ' 8' ' ' TRP . 52.0 ttp180 -130.83 126.22 35.69 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.249 -0.907 . . . . 0.0 109.474 179.51 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -129.63 139.03 51.53 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.227 -0.921 . . . . 0.0 109.499 -179.537 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.532 ' H ' ' HB2' ' A' ' 6' ' ' LYS . 77.9 tt0 -101.51 145.63 28.74 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.325 -0.859 . . . . 0.0 109.362 179.06 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.5 t -142.56 121.82 7.74 Favored Pre-proline 0 N--CA 1.49 1.572 0 O-C-N 121.115 -0.991 . . . . 0.0 109.54 -179.159 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -78.73 144.57 19.59 Favored 'Trans proline' 0 C--N 1.305 -1.755 0 C-N-CA 122.797 2.331 . . . . 0.0 112.161 178.879 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.81 ' H ' ' NE ' ' A' ' 24' ' ' ARG . 0.0 OUTLIER -91.52 176.01 6.7 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.181 -0.949 . . . . 0.0 109.489 179.563 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 95.9 mtt-85 -127.06 24.88 6.31 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.207 -0.933 . . . . 0.0 109.502 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.531 ' OG ' ' CB ' ' A' ' 29' ' ' SER . 97.0 p -64.86 161.61 17.96 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.286 -0.884 . . . . 0.0 109.468 -179.732 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -62.25 -96.78 0.01 OUTLIER Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.515 -1.434 . . . . 0.0 109.515 -179.568 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.53 ' C ' ' H ' ' A' ' 30' ' ' ALA . 96.7 mt -65.21 -34.73 79.06 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.299 -1.118 . . . . 0.0 109.553 -178.592 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.571 ' O ' ' OG ' ' A' ' 29' ' ' SER . 0.3 OUTLIER -70.96 21.92 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.241 -0.912 . . . . 0.0 109.443 -179.007 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.53 ' H ' ' C ' ' A' ' 28' ' ' LEU . . . -79.57 164.35 23.92 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.195 -0.94 . . . . 0.0 109.491 179.884 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.715 ' H ' ' NH1' ' A' ' 24' ' ' ARG . . . 86.7 -17.37 40.59 Favored Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.487 -1.445 . . . . 0.0 109.487 179.565 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.595 ' O ' ' NE ' ' A' ' 24' ' ' ARG . 75.7 m80 -79.25 126.35 30.67 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.259 -1.142 . . . . 0.0 109.395 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 7.4 mtp180 -112.08 118.82 36.46 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.218 -0.927 . . . . 0.0 109.492 179.554 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -91.96 139.49 30.6 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.235 -0.916 . . . . 0.0 109.394 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.6 t -106.7 123.03 61.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.271 -0.893 . . . . 0.0 109.405 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -107.36 140.61 40.02 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.208 -0.933 . . . . 0.0 109.47 179.571 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.544 ' CD1' ' CE1' ' A' ' 66' ' ' PHE . 71.9 m-85 -109.4 142.25 40.62 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.251 -0.906 . . . . 0.0 109.471 -179.216 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 80.2 m-85 -126.39 139.29 53.39 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.242 -0.911 . . . . 0.0 109.496 -179.742 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.405 ' CB ' ' HD2' ' A' ' 40' ' ' PRO . 0.4 OUTLIER -99.7 165.22 15.07 Favored Pre-proline 0 N--CA 1.49 1.568 0 O-C-N 121.362 -0.836 . . . . 0.0 109.443 179.53 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.405 ' HD2' ' CB ' ' A' ' 39' ' ' SER . 20.5 Cg_endo -60.47 -19.1 57.59 Favored 'Trans proline' 0 C--N 1.305 -1.747 0 C-N-CA 122.805 2.337 . . . . 0.0 112.201 179.833 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 56.7 p -88.52 0.04 56.73 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.361 -0.837 . . . . 0.0 109.511 179.411 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 85.6 13.11 70.91 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -78.21 117.66 19.7 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.204 -1.174 . . . . 0.0 109.479 -179.773 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.75 ' HZ3' HH11 ' A' ' 46' ' ' ARG . 62.8 tttm -92.81 128.37 38.64 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.295 -0.878 . . . . 0.0 109.402 178.689 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.635 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 1.1 p90 -140.24 146.8 39.12 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.202 -0.936 . . . . 0.0 109.479 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.75 HH11 ' HZ3' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -141.7 59.78 1.49 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.218 -0.926 . . . . 0.0 109.525 179.008 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.1 t -157.73 144.97 18.29 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.231 -0.918 . . . . 0.0 109.568 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.603 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 3.8 tttt -68.5 -46.06 36.23 Favored Pre-proline 0 N--CA 1.49 1.575 0 O-C-N 121.176 -0.953 . . . . 0.0 109.437 -179.355 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.603 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 45.6 Cg_exo -55.77 -46.72 29.59 Favored 'Trans proline' 0 C--N 1.306 -1.695 0 C-N-CA 122.77 2.314 . . . . 0.0 112.23 -179.689 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -67.16 -39.94 86.57 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.208 -0.933 . . . . 0.0 109.447 179.794 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 57.0 tp -64.87 -45.81 84.44 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.252 -0.905 . . . . 0.0 109.497 -179.476 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.691 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -69.98 -45.3 67.63 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.271 -0.893 . . . . 0.0 109.474 -179.288 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 77.5 ttt-85 -60.18 -43.52 95.78 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.2 -0.938 . . . . 0.0 109.545 -179.697 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 37.5 t80 -62.43 -55.61 26.06 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.293 -0.879 . . . . 0.0 109.518 -179.114 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.488 ' CD1' HD12 ' A' ' 13' ' ' LEU . 96.4 mt -90.34 4.92 49.4 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.202 -0.936 . . . . 0.0 109.532 179.885 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.691 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -48.6 -77.37 0.12 Allowed Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 -179.643 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.09 7.47 0.2 Allowed Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 -179.605 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.577 ' H ' ' C ' ' A' ' 56' ' ' GLY . 3.6 p -108.77 -26.85 10.09 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.209 -1.171 . . . . 0.0 109.498 -179.61 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.629 ' SD ' HD21 ' A' ' 61' ' ' LEU . 18.1 ptm -176.2 170.13 2.68 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.192 -0.942 . . . . 0.0 109.431 -179.843 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.518 ' O ' ' OD1' ' A' ' 60' ' ' ASP . 45.3 p-10 -97.24 116.47 29.51 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.317 -0.865 . . . . 0.0 109.452 179.655 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.629 HD21 ' SD ' ' A' ' 59' ' ' MET . 88.5 mt -111.8 16.45 20.45 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.352 -0.843 . . . . 0.0 109.463 -179.414 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 41.0 t -58.77 -39.28 80.57 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.284 -0.885 . . . . 0.0 109.436 -179.855 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 51.7 p -92.03 23.98 3.48 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.357 -0.84 . . . . 0.0 109.413 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 46.5 t80 -99.72 125.71 45.65 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.248 -0.907 . . . . 0.0 109.476 -179.729 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.437 ' OD2' ' OG1' ' A' ' 68' ' ' THR . 55.3 t0 -83.63 119.31 24.6 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.261 -0.899 . . . . 0.0 109.418 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.544 ' CE1' ' CD1' ' A' ' 37' ' ' TYR . 73.8 t80 -83.02 -33.23 26.55 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.235 -0.916 . . . . 0.0 109.541 -179.541 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 42.3 ttm180 -66.18 -43.94 85.43 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.264 -0.897 . . . . 0.0 109.529 -179.214 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.631 ' O ' ' NH1' ' A' ' 19' ' ' ARG . 11.3 p -96.47 -15.91 21.45 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.278 -0.889 . . . . 0.0 109.503 -179.867 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.52 ' HA3' HH11 ' A' ' 19' ' ' ARG . . . 64.52 60.45 7.02 Favored Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.497 -1.441 . . . . 0.0 109.497 179.375 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -152.96 149.74 28.52 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.318 -1.107 . . . . 0.0 109.423 179.599 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 34.6 ttm -91.63 121.41 33.27 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.208 -0.932 . . . . 0.0 109.522 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.54 HD23 ' C ' ' A' ' 72' ' ' LEU . 3.4 tt . . . . . 0 N--CA 1.491 1.598 0 O-C-N 121.278 -0.889 . . . . 0.0 109.458 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.527 4.736 0 N-CA-C 119.538 2.575 . . . . 0.0 119.538 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 54.6 p -148.15 -157.69 0.84 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.219 -1.165 . . . . 0.0 109.462 179.744 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 72.5 mtm -72.87 101.87 3.27 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.334 -0.854 . . . . 0.0 109.445 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.604 ' O ' ' C ' ' A' ' 5' ' ' ARG . 96.4 mt-10 -96.61 165.3 12.21 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.257 -0.902 . . . . 0.0 109.502 179.712 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.604 ' C ' ' O ' ' A' ' 4' ' ' GLU . 5.7 ptp180 31.51 95.12 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.19 -0.944 . . . . 0.0 109.451 179.332 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.585 ' NZ ' ' O ' ' A' ' 21' ' ' GLU . 0.3 OUTLIER -120.68 123.35 42.53 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.294 -0.879 . . . . 0.0 109.526 179.948 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 83.7 mtp180 -100.66 108.44 20.32 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.246 -0.909 . . . . 0.0 109.501 -179.306 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 15.2 m0 -104.37 169.71 8.32 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.212 -0.93 . . . . 0.0 109.472 178.868 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -88.83 146.04 25.21 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.212 -0.93 . . . . 0.0 109.408 -179.661 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 17.8 t -121.34 100.73 44.67 Favored Pre-proline 0 N--CA 1.489 1.484 0 O-C-N 121.247 -0.908 . . . . 0.0 109.499 179.881 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -53.11 -40.18 77.7 Favored 'Trans proline' 0 C--N 1.304 -1.776 0 C-N-CA 122.864 2.376 . . . . 0.0 112.23 -179.816 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.42 -28.95 60.9 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.262 -0.899 . . . . 0.0 109.52 -179.725 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 14.5 mt -91.67 151.38 42.31 Favored Pre-proline 0 N--CA 1.49 1.53 0 O-C-N 121.302 -0.874 . . . . 0.0 109.436 -179.757 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -51.1 154.6 7.34 Favored 'Trans proline' 0 C--N 1.306 -1.709 0 C-N-CA 122.746 2.297 . . . . 0.0 112.256 179.029 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 89.5 mt-30 -58.25 121.02 9.73 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.254 -0.904 . . . . 0.0 109.477 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 124.52 -36.19 2.97 Favored Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 -179.766 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' TRP . . . . . 0.432 ' CZ2' HD11 ' A' ' 55' ' ' LEU . 37.5 m95 -74.61 149.02 40.22 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.219 -1.165 . . . . 0.0 109.453 178.967 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -139.46 153.35 47.53 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.139 -0.976 . . . . 0.0 109.489 -178.437 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.552 ' NH1' ' O ' ' A' ' 68' ' ' THR . 60.8 ttp180 -106.56 156.44 18.58 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.179 -0.951 . . . . 0.0 109.423 178.544 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.408 ' N ' ' HG2' ' A' ' 19' ' ' ARG . 39.2 tt0 -142.53 140.53 31.84 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.226 -0.921 . . . . 0.0 109.557 -178.572 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.585 ' O ' ' NZ ' ' A' ' 6' ' ' LYS . 81.2 mm-40 -113.92 121.04 42.74 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.187 -0.945 . . . . 0.0 109.407 178.004 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 39.2 t -128.79 133.78 25.58 Favored Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.215 -0.928 . . . . 0.0 109.609 -178.671 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -76.47 171.45 18.04 Favored 'Trans proline' 0 C--N 1.306 -1.703 0 C-N-CA 122.825 2.35 . . . . 0.0 112.221 178.21 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.548 ' NE ' ' OD2' ' A' ' 34' ' ' ASP . 12.7 mmt85 -105.55 126.86 52.62 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.333 -0.854 . . . . 0.0 109.366 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.752 ' O ' ' C ' ' A' ' 26' ' ' SER . 85.0 mtp180 -106.3 -34.71 7.38 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.112 -0.992 . . . . 0.0 109.512 -179.568 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.752 ' C ' ' O ' ' A' ' 25' ' ' ARG . 81.1 p 4.27 -112.17 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.241 -0.912 . . . . 0.0 109.477 -179.431 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -150.99 -94.69 0.11 Allowed Glycine 0 N--CA 1.49 2.235 0 N-CA-C 109.621 -1.392 . . . . 0.0 109.621 179.86 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 56.2 tp -68.28 -46.55 70.06 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.226 -1.161 . . . . 0.0 109.414 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 37.7 t -70.61 -10.19 58.73 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.322 -0.862 . . . . 0.0 109.429 -179.908 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.508 ' HB2' ' O ' ' A' ' 25' ' ' ARG . . . -51.01 147.89 4.75 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.26 -0.9 . . . . 0.0 109.459 179.589 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 124.37 -34.23 3.57 Favored Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 36.2 m80 -73.89 169.48 17.32 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.247 -1.149 . . . . 0.0 109.454 178.649 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 19.1 ptp180 -128.94 150.75 50.25 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.212 -0.93 . . . . 0.0 109.493 -179.491 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.548 ' OD2' ' NE ' ' A' ' 24' ' ' ARG . 69.5 m-20 -129.68 146.24 51.47 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.264 -0.897 . . . . 0.0 109.454 179.497 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.473 HG22 ' OE1' ' A' ' 21' ' ' GLU . 33.3 t -105.06 132.4 51.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.225 -0.922 . . . . 0.0 109.446 -179.258 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 81.3 m-85 -122.75 152.45 40.61 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.161 -0.962 . . . . 0.0 109.505 179.137 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 68.0 m-85 -123.87 149.29 45.97 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.193 -0.942 . . . . 0.0 109.49 -179.703 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 53.5 m-85 -116.08 128.19 55.48 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.263 -0.898 . . . . 0.0 109.643 -179.397 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.535 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.5 OUTLIER -92.61 -177.94 0.8 Allowed Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.299 -0.876 . . . . 0.0 109.444 179.195 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.535 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 51.2 Cg_exo -55.37 -31.44 77.36 Favored 'Trans proline' 0 C--N 1.305 -1.746 0 C-N-CA 122.885 2.39 . . . . 0.0 112.248 -179.544 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.452 ' O ' ' OG ' ' A' ' 41' ' ' SER . 0.1 OUTLIER -93.05 11.81 26.28 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.184 -0.947 . . . . 0.0 109.528 179.019 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 73.66 14.85 79.54 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 -179.855 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 5.6 ttmt -64.36 128.73 37.05 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.175 -1.191 . . . . 0.0 109.44 -179.504 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 9.8 mtpm? -94.45 118.09 31.12 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.282 -0.886 . . . . 0.0 109.455 178.685 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 55.0 p90 -139.4 146.21 39.89 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.284 -0.885 . . . . 0.0 109.44 -179.638 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 26.6 ptt180 -126.32 57.78 1.39 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.336 -0.852 . . . . 0.0 109.493 179.345 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.5 t -150.45 130.33 13.33 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.236 -0.915 . . . . 0.0 109.504 179.779 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.852 ' N ' ' HD2' ' A' ' 49' ' ' PRO . 7.6 tmtt? -63.48 -46.81 84.17 Favored Pre-proline 0 N--CA 1.49 1.533 0 O-C-N 121.222 -0.924 . . . . 0.0 109.503 -179.915 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.852 ' HD2' ' N ' ' A' ' 48' ' ' LYS . 18.3 Cg_endo -57.95 -37.08 97.43 Favored 'Trans proline' 0 C--N 1.305 -1.734 0 C-N-CA 122.812 2.341 . . . . 0.0 112.235 178.971 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -67.66 -38.28 83.57 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.207 -0.933 . . . . 0.0 109.478 179.277 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.698 ' O ' HD23 ' A' ' 51' ' ' LEU . 2.0 tt -63.64 -42.32 98.14 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.26 -0.9 . . . . 0.0 109.505 -179.817 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.89 -39.75 90.94 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.28 -0.888 . . . . 0.0 109.491 -179.551 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 13.6 tpp180 -55.9 -45.98 78.48 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.254 -0.904 . . . . 0.0 109.521 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -62.59 -47.87 81.9 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.24 -0.913 . . . . 0.0 109.484 179.537 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.432 HD11 ' CZ2' ' A' ' 17' ' ' TRP . 8.1 mp -65.26 -0.59 1.84 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.291 -0.88 . . . . 0.0 109.437 179.504 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.551 ' O ' ' C ' ' A' ' 57' ' ' GLY . . . 56.37 60.36 9.09 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.616 -1.394 . . . . 0.0 109.616 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLY . . . . . 0.551 ' C ' ' O ' ' A' ' 56' ' ' GLY . . . 34.34 38.41 0.11 Allowed Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 -179.351 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.468 ' N ' ' O ' ' A' ' 56' ' ' GLY . 89.0 p -88.95 -0.89 57.79 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.294 -1.121 . . . . 0.0 109.436 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.499 ' CE ' HD21 ' A' ' 61' ' ' LEU . 33.1 ttp -155.46 148.74 24.82 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.224 -0.922 . . . . 0.0 109.548 -179.736 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 55.1 t0 -85.76 101.81 13.11 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.232 -0.917 . . . . 0.0 109.482 -179.585 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.499 HD21 ' CE ' ' A' ' 59' ' ' MET . 89.1 mt -96.41 1.18 51.47 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.258 -0.901 . . . . 0.0 109.449 179.56 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 58.6 m -54.93 -27.19 41.49 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.143 -0.973 . . . . 0.0 109.458 179.585 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 36.1 p -94.11 1.46 56.13 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.27 -0.894 . . . . 0.0 109.547 179.563 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.435 ' CZ ' ' HA2' ' A' ' 69' ' ' GLY . 72.9 t80 -87.87 114.52 24.56 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.247 -0.908 . . . . 0.0 109.512 179.459 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -76.23 136.81 39.69 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.268 -0.895 . . . . 0.0 109.465 -179.498 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 69.4 t80 -89.15 -37.34 15.13 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.144 -0.972 . . . . 0.0 109.44 179.446 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 29.0 tpt85 -59.35 -44.44 92.67 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.278 -0.889 . . . . 0.0 109.461 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.552 ' O ' ' NH1' ' A' ' 19' ' ' ARG . 33.1 p -97.54 -20.53 17.65 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.324 -0.86 . . . . 0.0 109.485 179.659 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.457 ' HA3' HH11 ' A' ' 19' ' ' ARG . . . 67.21 31.46 77.47 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.56 -1.416 . . . . 0.0 109.56 179.667 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.407 ' HZ2' HH12 ' A' ' 19' ' ' ARG . 64.6 mttp -132.11 152.58 51.15 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.232 -1.157 . . . . 0.0 109.525 -179.655 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 17.4 mtt -78.73 144.53 35.16 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.211 -0.931 . . . . 0.0 109.466 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.661 HD23 ' C ' ' A' ' 72' ' ' LEU . 5.1 tt . . . . . 0 N--CA 1.49 1.564 0 O-C-N 121.213 -0.929 . . . . 0.0 109.413 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.529 4.879 0 N-CA-C 119.384 2.513 . . . . 0.0 119.384 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 86.5 p -89.17 -1.48 58.11 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.214 -1.168 . . . . 0.0 109.536 179.877 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 81.4 mmm 46.18 -144.88 0.22 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.248 -0.907 . . . . 0.0 109.456 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.572 ' O ' ' O ' ' A' ' 5' ' ' ARG . 15.9 pt-20 -93.26 34.58 1.13 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.329 -0.857 . . . . 0.0 109.442 -179.187 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.584 ' NH2' ' OE2' ' A' ' 20' ' ' GLU . 50.0 mtp180 57.45 139.55 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.182 -0.949 . . . . 0.0 109.479 179.625 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.425 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 10.9 mptt -74.68 158.29 33.84 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.304 -0.872 . . . . 0.0 109.452 -179.0 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 79.8 mtp180 -150.92 140.26 21.37 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.246 -0.909 . . . . 0.0 109.456 -179.171 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.589 ' CD1' ' N ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -167.75 140.88 3.31 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.228 -0.92 . . . . 0.0 109.389 179.213 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -87.68 136.13 33.08 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.168 -0.957 . . . . 0.0 109.465 178.586 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 32.8 m -94.03 141.05 23.16 Favored Pre-proline 0 N--CA 1.489 1.511 0 O-C-N 121.149 -0.969 . . . . 0.0 109.505 -179.701 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -70.27 -14.81 34.89 Favored 'Trans proline' 0 C--N 1.304 -1.773 0 C-N-CA 122.893 2.396 . . . . 0.0 112.249 179.713 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.4 ' HB2' ' SD ' ' A' ' 71' ' ' MET . . . -90.78 -11.71 38.64 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.206 -0.934 . . . . 0.0 109.483 179.835 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 7.7 mp -99.71 148.95 35.46 Favored Pre-proline 0 N--CA 1.49 1.553 0 O-C-N 121.183 -0.948 . . . . 0.0 109.456 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.408 ' HG2' ' CD1' ' A' ' 17' ' ' TRP . 47.2 Cg_endo -70.21 148.88 63.15 Favored 'Trans proline' 0 C--N 1.305 -1.738 0 C-N-CA 122.858 2.372 . . . . 0.0 112.213 178.983 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -52.97 129.31 30.12 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.313 -0.867 . . . . 0.0 109.52 -179.463 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 122.84 -25.09 6.56 Favored Glycine 0 N--CA 1.489 2.211 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 179.465 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' TRP . . . . . 0.434 ' CD1' ' N ' ' A' ' 17' ' ' TRP . 14.1 m95 -86.76 152.11 22.8 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.226 -1.161 . . . . 0.0 109.479 179.652 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -129.48 147.13 51.26 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.165 -0.96 . . . . 0.0 109.545 -179.422 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.553 ' NH1' ' NE1' ' A' ' 8' ' ' TRP . 75.0 ttt-85 -128.23 125.74 39.55 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.231 -0.918 . . . . 0.0 109.432 179.581 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.588 ' OE2' ' CE1' ' A' ' 38' ' ' TYR . 21.8 pt-20 -134.1 139.34 45.87 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.201 -0.937 . . . . 0.0 109.461 -179.553 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -101.55 151.3 22.14 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.278 -0.888 . . . . 0.0 109.4 -179.778 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.1 t -136.14 122.52 13.99 Favored Pre-proline 0 N--CA 1.491 1.578 0 O-C-N 121.226 -0.921 . . . . 0.0 109.518 -179.533 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' PRO . . . . . 0.414 ' CB ' ' NH1' ' A' ' 33' ' ' ARG . 62.0 Cg_endo -77.01 140.14 19.88 Favored 'Trans proline' 0 C--N 1.306 -1.689 0 C-N-CA 122.814 2.342 . . . . 0.0 112.109 -178.766 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.456 HH11 ' HB2' ' A' ' 29' ' ' SER . 38.5 ttm180 -89.9 168.04 12.35 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.157 -0.964 . . . . 0.0 109.522 178.5 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.612 ' O ' ' O ' ' A' ' 26' ' ' SER . 90.8 mtm180 -119.06 -139.18 0.35 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.269 -0.894 . . . . 0.0 109.475 -178.832 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.612 ' O ' ' O ' ' A' ' 25' ' ' ARG . 12.6 p -38.14 166.06 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.248 -0.907 . . . . 0.0 109.496 -179.391 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 108.91 153.15 15.56 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 -179.127 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.545 ' C ' ' H ' ' A' ' 30' ' ' ALA . 95.0 mt -59.43 -41.74 90.26 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.33 -1.1 . . . . 0.0 109.458 -179.752 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.456 ' HB2' HH11 ' A' ' 24' ' ' ARG . 2.9 m -70.78 30.38 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.185 -0.947 . . . . 0.0 109.458 178.846 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.545 ' H ' ' C ' ' A' ' 28' ' ' LEU . . . -66.36 150.71 48.46 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.236 -0.915 . . . . 0.0 109.405 -179.77 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 78.65 -17.72 6.49 Favored Glycine 0 N--CA 1.49 2.268 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.676 ' C ' ' HE ' ' A' ' 33' ' ' ARG . 58.4 m80 -71.4 131.73 43.79 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.352 -1.087 . . . . 0.0 109.496 179.773 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.676 ' HE ' ' C ' ' A' ' 32' ' ' HIS . 0.4 OUTLIER -107.49 107.82 18.85 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.252 -0.905 . . . . 0.0 109.481 -179.261 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.511 ' OD1' ' N ' ' A' ' 35' ' ' VAL . 58.4 t0 -77.8 134.94 37.91 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.303 -0.873 . . . . 0.0 109.505 179.41 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.511 ' N ' ' OD1' ' A' ' 34' ' ' ASP . 47.1 t -105.45 128.13 59.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.247 -0.908 . . . . 0.0 109.47 -179.796 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.418 ' CZ ' ' OD2' ' A' ' 34' ' ' ASP . 72.7 m-85 -115.14 142.89 46.05 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.172 -0.955 . . . . 0.0 109.427 179.251 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.409 ' HB2' ' CE2' ' A' ' 45' ' ' PHE . 52.8 m-85 -111.22 142.73 43.03 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.273 -0.892 . . . . 0.0 109.462 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.588 ' CE1' ' OE2' ' A' ' 20' ' ' GLU . 19.9 m-85 -118.14 135.85 53.97 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.251 -0.905 . . . . 0.0 109.445 179.793 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.438 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -94.26 176.88 2.13 Favored Pre-proline 0 N--CA 1.49 1.551 0 O-C-N 121.231 -0.918 . . . . 0.0 109.474 179.55 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.438 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 42.1 Cg_exo -55.47 -29.88 71.07 Favored 'Trans proline' 0 C--N 1.304 -1.795 0 C-N-CA 122.897 2.398 . . . . 0.0 112.243 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 66.8 m -91.05 -2.29 57.67 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.176 -0.952 . . . . 0.0 109.548 -179.396 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 88.32 22.1 42.27 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.556 -1.418 . . . . 0.0 109.556 179.748 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 46.9 tttp -75.06 129.13 37.08 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.273 -1.133 . . . . 0.0 109.421 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 47.5 mtpt -94.27 120.87 35.14 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.263 -0.898 . . . . 0.0 109.531 179.301 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.599 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 2.0 p90 -141.68 150.63 42.13 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.197 -0.939 . . . . 0.0 109.389 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 10.6 ptm180 -143.04 68.94 1.3 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.331 -0.855 . . . . 0.0 109.453 179.194 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -148.1 129.45 14.77 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.179 -0.951 . . . . 0.0 109.439 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.639 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -61.2 -42.95 88.52 Favored Pre-proline 0 N--CA 1.488 1.448 0 O-C-N 121.209 -0.932 . . . . 0.0 109.461 -179.33 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.639 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 32.0 Cg_exo -58.2 -40.26 77.93 Favored 'Trans proline' 0 C--N 1.305 -1.752 0 C-N-CA 122.845 2.363 . . . . 0.0 112.242 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -65.79 -38.86 90.15 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.29 -0.881 . . . . 0.0 109.516 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.443 HD11 ' CE2' ' A' ' 45' ' ' PHE . 8.9 mp -65.29 -45.53 84.04 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.223 -0.923 . . . . 0.0 109.46 -179.667 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.667 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -72.35 -48.08 44.64 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.337 -0.852 . . . . 0.0 109.515 -179.379 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 80.1 mtp180 -58.9 -32.52 69.59 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.203 -0.936 . . . . 0.0 109.473 -179.413 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 24.2 t80 -86.01 -55.08 4.11 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.301 -0.875 . . . . 0.0 109.446 -178.55 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.404 ' O ' ' C ' ' A' ' 56' ' ' GLY . 95.2 mt -93.85 6.2 49.18 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.263 -0.898 . . . . 0.0 109.411 -178.217 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.667 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -45.55 -72.29 0.39 Allowed Glycine 0 N--CA 1.492 2.374 0 N-CA-C 109.475 -1.45 . . . . 0.0 109.475 -179.599 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -57.41 -43.7 93.82 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 -179.016 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 54.1 p -58.2 -34.64 70.59 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.243 -1.151 . . . . 0.0 109.44 -179.344 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.404 ' N ' ' O ' ' A' ' 55' ' ' LEU . 1.7 mmm -170.53 162.82 8.23 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.33 -0.856 . . . . 0.0 109.472 -179.61 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 56.2 t0 -95.42 114.69 26.48 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.238 -0.914 . . . . 0.0 109.499 179.885 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 97.0 mt -106.67 3.13 26.43 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.277 -0.89 . . . . 0.0 109.501 -179.073 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 78.7 p -52.75 -36.76 58.36 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.263 -0.898 . . . . 0.0 109.408 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 54.3 p -81.17 14.45 2.34 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.273 -0.892 . . . . 0.0 109.457 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.625 ' O ' ' NZ ' ' A' ' 48' ' ' LYS . 47.0 t80 -88.75 133.15 34.33 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.255 -0.903 . . . . 0.0 109.402 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.499 ' O ' ' N ' ' A' ' 69' ' ' GLY . 64.4 t0 -82.87 114.11 20.95 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.299 -0.876 . . . . 0.0 109.48 -179.734 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 64.0 t80 -75.02 -44.89 45.4 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.249 -0.907 . . . . 0.0 109.477 -179.068 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.61 -46.09 84.52 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.314 -0.866 . . . . 0.0 109.459 -179.214 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.534 ' O ' ' NH2' ' A' ' 19' ' ' ARG . 43.3 p -94.71 -13.45 25.74 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.245 -0.91 . . . . 0.0 109.486 -179.836 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.507 ' HA3' ' HE ' ' A' ' 19' ' ' ARG . . . 61.72 40.23 98.5 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 179.732 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -137.75 157.21 46.92 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.267 -1.137 . . . . 0.0 109.468 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.4 ' SD ' ' HB2' ' A' ' 12' ' ' ALA . 3.0 ttt -84.6 122.97 29.8 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.197 -0.939 . . . . 0.0 109.422 -179.684 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 7.2 tt . . . . . 0 N--CA 1.49 1.572 0 O-C-N 121.334 -0.854 . . . . 0.0 109.449 -179.908 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.529 4.88 0 N-CA-C 119.437 2.535 . . . . 0.0 119.437 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.4 m -74.07 150.25 40.68 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.315 -1.109 . . . . 0.0 109.577 179.618 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.442 ' O ' ' C ' ' A' ' 4' ' ' GLU . 66.6 mtt 50.9 -169.8 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.279 -0.888 . . . . 0.0 109.464 -179.951 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.442 ' C ' ' O ' ' A' ' 3' ' ' MET . 83.9 tt0 42.65 88.16 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.348 -0.845 . . . . 0.0 109.446 -179.974 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.425 ' N ' ' OE2' ' A' ' 20' ' ' GLU . 8.3 tpm_? -71.21 -110.3 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.283 -0.886 . . . . 0.0 109.411 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.412 ' N ' ' HG3' ' A' ' 5' ' ' ARG . 7.4 ptmt -115.98 109.81 18.08 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.196 -0.94 . . . . 0.0 109.496 179.465 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -120.88 133.61 55.3 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.22 -0.925 . . . . 0.0 109.493 -179.424 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.444 ' HB2' ' HE ' ' A' ' 19' ' ' ARG . 2.0 m0 -129.82 175.97 8.41 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.232 -0.918 . . . . 0.0 109.502 179.879 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 -75.38 143.39 42.81 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.258 -0.902 . . . . 0.0 109.417 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.2 t -101.93 108.5 56.65 Favored Pre-proline 0 N--CA 1.49 1.575 0 O-C-N 121.259 -0.901 . . . . 0.0 109.448 179.703 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -77.01 -14.99 16.69 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 C-N-CA 122.891 2.394 . . . . 0.0 112.226 -179.223 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -71.39 -40.33 70.62 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.274 -0.891 . . . . 0.0 109.402 -179.746 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.524 ' N ' HD23 ' A' ' 13' ' ' LEU . 0.3 OUTLIER -96.19 -179.59 0.95 Allowed Pre-proline 0 N--CA 1.49 1.527 0 O-C-N 121.236 -0.915 . . . . 0.0 109.433 -179.947 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.517 ' CD ' ' CB ' ' A' ' 13' ' ' LEU . 33.6 Cg_exo -60.34 145.91 97.67 Favored 'Trans proline' 0 C--N 1.306 -1.701 0 C-N-CA 122.786 2.324 . . . . 0.0 112.247 -179.481 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 19.2 mm100 -51.79 128.85 24.94 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.175 -0.953 . . . . 0.0 109.524 -179.821 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 123.96 -24.17 6.41 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.626 -1.39 . . . . 0.0 109.626 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 31.0 m95 -84.16 145.91 28.13 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.28 -1.129 . . . . 0.0 109.483 179.308 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -138.42 154.93 48.89 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.228 -0.92 . . . . 0.0 109.527 -179.458 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.598 ' CD ' ' H ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -126.59 162.17 26.32 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.294 -0.879 . . . . 0.0 109.474 179.252 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.425 ' OE2' ' N ' ' A' ' 5' ' ' ARG . 78.0 tt0 -143.22 144.55 32.2 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.219 -0.925 . . . . 0.0 109.48 -179.004 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -113.07 132.68 55.32 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.192 -0.942 . . . . 0.0 109.387 179.467 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.5 t -127.53 108.95 20.89 Favored Pre-proline 0 N--CA 1.491 1.589 0 O-C-N 121.217 -0.927 . . . . 0.0 109.609 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -74.53 142.72 29.84 Favored 'Trans proline' 0 C--N 1.305 -1.713 0 C-N-CA 122.811 2.341 . . . . 0.0 112.127 -178.557 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.414 ' NE ' ' OG ' ' A' ' 29' ' ' SER . 80.6 mtp85 -97.78 172.27 7.79 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.189 -0.944 . . . . 0.0 109.448 179.059 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.482 ' O ' ' OG ' ' A' ' 26' ' ' SER . 59.8 ttp180 -174.44 62.88 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.252 -0.905 . . . . 0.0 109.476 -179.416 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.482 ' OG ' ' O ' ' A' ' 25' ' ' ARG . 1.6 m 168.32 78.75 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.206 -0.934 . . . . 0.0 109.516 179.25 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 143.54 178.87 19.7 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 179.829 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.547 ' C ' ' H ' ' A' ' 30' ' ' ALA . 3.9 mm? -60.61 -40.4 91.73 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.303 -1.116 . . . . 0.0 109.435 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.414 ' OG ' ' NE ' ' A' ' 24' ' ' ARG . 78.9 p -70.39 29.67 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.267 -0.896 . . . . 0.0 109.422 179.805 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.547 ' H ' ' C ' ' A' ' 28' ' ' LEU . . . -66.35 146.73 54.25 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.26 -0.9 . . . . 0.0 109.455 179.703 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 78.95 -14.83 12.02 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 78.5 m80 -86.11 130.74 34.43 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.215 -1.168 . . . . 0.0 109.375 179.645 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 36.2 ptt-85 -112.26 132.77 54.76 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.203 -0.935 . . . . 0.0 109.56 -179.738 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -87.88 142.24 27.96 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.266 -0.896 . . . . 0.0 109.475 179.289 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 59.6 t -112.72 125.74 70.02 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.317 -0.865 . . . . 0.0 109.496 179.91 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 84.0 m-85 -112.98 144.28 42.83 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.238 -0.913 . . . . 0.0 109.518 179.11 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.668 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 49.9 m-85 -112.71 148.46 34.66 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.233 -0.917 . . . . 0.0 109.455 -179.786 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.569 ' CD1' ' N ' ' A' ' 38' ' ' TYR . 3.1 m-85 -127.88 140.37 52.06 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.312 -0.867 . . . . 0.0 109.609 -179.934 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.431 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -96.21 176.64 2.07 Favored Pre-proline 0 N--CA 1.491 1.606 0 O-C-N 121.214 -0.929 . . . . 0.0 109.467 179.775 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.431 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 53.1 Cg_exo -54.29 -30.13 60.86 Favored 'Trans proline' 0 C--N 1.305 -1.728 0 C-N-CA 122.797 2.332 . . . . 0.0 112.252 179.568 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 11.7 t -88.0 -3.27 58.93 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.248 -0.908 . . . . 0.0 109.477 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 87.61 21.97 45.39 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.549 -1.421 . . . . 0.0 109.549 -179.673 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 61.6 tttp -73.57 123.76 24.59 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.306 -1.114 . . . . 0.0 109.452 -179.668 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -90.8 121.59 32.8 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.267 -0.895 . . . . 0.0 109.443 179.331 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.447 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 8.9 p90 -141.07 148.17 39.75 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.21 -0.931 . . . . 0.0 109.511 179.763 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -142.31 70.61 1.33 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.207 -0.933 . . . . 0.0 109.49 179.137 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.432 ' O ' HD23 ' A' ' 51' ' ' LEU . 1.5 p -158.67 144.44 16.68 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.296 -0.877 . . . . 0.0 109.423 179.575 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.675 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 12.9 tptt -65.46 -41.71 52.19 Favored Pre-proline 0 N--CA 1.49 1.547 0 O-C-N 121.316 -0.865 . . . . 0.0 109.455 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.675 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 39.0 Cg_exo -57.23 -40.35 83.22 Favored 'Trans proline' 0 C--N 1.306 -1.699 0 C-N-CA 122.839 2.36 . . . . 0.0 112.259 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -68.22 -39.1 82.45 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.202 -0.936 . . . . 0.0 109.46 179.747 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.432 HD23 ' O ' ' A' ' 47' ' ' SER . 4.0 mm? -61.92 -46.34 89.79 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.253 -0.904 . . . . 0.0 109.457 -179.504 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.633 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -73.9 -42.81 60.11 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.339 -0.851 . . . . 0.0 109.452 -179.361 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 75.7 ttt180 -58.59 -47.32 84.72 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.296 -0.877 . . . . 0.0 109.515 -179.912 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 18.4 t80 -69.8 -53.88 16.19 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.222 -0.924 . . . . 0.0 109.479 -179.454 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.438 ' O ' ' N ' ' A' ' 57' ' ' GLY . 96.0 mt -80.35 0.39 33.27 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.288 -0.883 . . . . 0.0 109.45 -179.142 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.633 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -56.98 89.72 0.01 OUTLIER Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' GLY . . . . . 0.438 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . 133.18 -1.08 4.49 Favored Glycine 0 N--CA 1.491 2.346 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 -179.885 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 32.2 t -105.23 -31.02 9.3 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.27 -1.135 . . . . 0.0 109.457 179.786 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 3.1 ptp -178.71 176.75 0.94 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.33 -0.856 . . . . 0.0 109.512 -179.831 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -85.86 104.64 15.71 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.214 -0.929 . . . . 0.0 109.436 179.462 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -85.98 -0.89 56.62 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.162 -0.961 . . . . 0.0 109.453 -179.662 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 40.9 t -53.67 -37.64 63.38 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.157 -0.964 . . . . 0.0 109.442 -179.811 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' THR . . . . . 0.51 ' O ' ' SD ' ' A' ' 71' ' ' MET . 37.8 p -95.23 45.68 1.1 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.207 -0.933 . . . . 0.0 109.43 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 26.3 t80 -121.26 129.86 53.37 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.259 -0.901 . . . . 0.0 109.478 -179.69 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.454 ' O ' ' N ' ' A' ' 69' ' ' GLY . 57.9 t0 -90.2 110.17 21.22 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.266 -0.897 . . . . 0.0 109.418 -179.974 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.668 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 74.6 t80 -77.19 -40.27 45.86 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.233 -0.917 . . . . 0.0 109.445 -179.915 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 26.6 mmt180 -61.07 -39.31 89.4 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.23 -0.919 . . . . 0.0 109.53 -179.609 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.443 ' OG1' ' CG ' ' A' ' 65' ' ' ASP . 34.6 p -100.35 -15.45 17.98 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.27 -0.894 . . . . 0.0 109.516 -179.528 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.454 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 64.21 42.64 97.84 Favored Glycine 0 N--CA 1.491 2.336 0 N-CA-C 109.542 -1.423 . . . . 0.0 109.542 179.661 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.5 tppt? -135.9 143.46 45.01 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.24 -1.153 . . . . 0.0 109.468 179.83 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.51 ' SD ' ' O ' ' A' ' 63' ' ' THR . 35.8 tpp -85.23 131.72 34.38 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.244 -0.91 . . . . 0.0 109.5 -179.616 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.566 HD23 ' C ' ' A' ' 72' ' ' LEU . 4.4 tt . . . . . 0 N--CA 1.491 1.588 0 O-C-N 121.177 -0.952 . . . . 0.0 109.442 -179.761 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.528 4.819 0 N-CA-C 119.494 2.557 . . . . 0.0 119.494 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 60.72 9.22 2.08 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.187 -1.184 . . . . 0.0 109.397 179.593 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.475 ' O ' ' N ' ' A' ' 5' ' ' ARG . 26.3 ttt -68.72 101.13 1.26 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.336 -0.853 . . . . 0.0 109.438 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.459 ' C ' ' O ' ' A' ' 3' ' ' MET . 69.9 mm-40 41.12 27.61 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.285 -0.884 . . . . 0.0 109.48 -179.8 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.475 ' N ' ' O ' ' A' ' 3' ' ' MET . 62.9 ttp180 -151.93 102.11 2.8 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.288 -0.883 . . . . 0.0 109.43 -179.876 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 56.7 mttt -74.12 163.27 28.07 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.202 -0.936 . . . . 0.0 109.481 179.882 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.589 ' O ' ' CD1' ' A' ' 8' ' ' TRP . 15.0 mmt180 -142.38 134.03 26.78 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.248 -0.907 . . . . 0.0 109.499 -178.617 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.589 ' CD1' ' O ' ' A' ' 7' ' ' ARG . 5.8 m0 -159.62 132.81 6.95 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.147 -0.97 . . . . 0.0 109.477 179.831 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -73.62 148.55 42.76 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.251 -0.906 . . . . 0.0 109.465 179.286 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.433 ' SG ' HD13 ' A' ' 13' ' ' LEU . 34.1 t -112.69 100.99 52.11 Favored Pre-proline 0 N--CA 1.488 1.448 0 O-C-N 121.236 -0.915 . . . . 0.0 109.523 -179.585 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_exo -54.2 -29.14 55.18 Favored 'Trans proline' 0 C--N 1.306 -1.705 0 C-N-CA 122.885 2.39 . . . . 0.0 112.204 179.092 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.591 ' HB2' ' HG3' ' A' ' 71' ' ' MET . . . -66.25 -24.53 66.6 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.334 -0.854 . . . . 0.0 109.502 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.571 ' CD1' ' N ' ' A' ' 13' ' ' LEU . 4.8 mp -96.1 155.84 37.76 Favored Pre-proline 0 N--CA 1.489 1.519 0 O-C-N 121.263 -0.898 . . . . 0.0 109.542 -179.841 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.675 ' HG3' HD11 ' A' ' 55' ' ' LEU . 37.7 Cg_exo -59.34 143.8 99.61 Favored 'Trans proline' 0 C--N 1.305 -1.719 0 C-N-CA 122.799 2.333 . . . . 0.0 112.182 179.273 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 70.5 tp60 -47.81 129.44 14.2 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.278 -0.889 . . . . 0.0 109.491 179.601 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 119.24 -21.9 9.16 Favored Glycine 0 N--CA 1.489 2.214 0 N-CA-C 109.576 -1.409 . . . . 0.0 109.576 -179.317 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' TRP . . . . . 0.41 ' N ' ' CD1' ' A' ' 17' ' ' TRP . 15.9 m95 -83.73 151.35 25.28 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.219 -1.165 . . . . 0.0 109.456 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -128.94 146.05 51.06 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.239 -0.913 . . . . 0.0 109.472 -179.394 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.533 ' NH2' HG11 ' A' ' 35' ' ' VAL . 77.8 ttt-85 -127.86 123.87 36.12 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.242 -0.911 . . . . 0.0 109.478 178.853 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.543 ' OE1' ' CZ ' ' A' ' 7' ' ' ARG . 7.2 pt-20 -131.37 138.92 49.35 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.254 -0.903 . . . . 0.0 109.529 -179.834 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 46.0 tt0 -94.39 143.95 25.97 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.333 -0.854 . . . . 0.0 109.423 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.411 HG13 ' HD2' ' A' ' 23' ' ' PRO . 47.3 t -126.5 135.56 27.41 Favored Pre-proline 0 N--CA 1.49 1.552 0 O-C-N 121.206 -0.933 . . . . 0.0 109.606 -179.257 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' PRO . . . . . 0.429 ' O ' ' N ' ' A' ' 25' ' ' ARG . 34.9 Cg_endo -65.58 152.21 82.47 Favored 'Trans proline' 0 C--N 1.304 -1.772 0 C-N-CA 122.828 2.352 . . . . 0.0 112.214 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.511 ' CZ ' ' O ' ' A' ' 24' ' ' ARG . 0.6 OUTLIER -59.86 87.88 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.258 -0.901 . . . . 0.0 109.504 -178.992 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.429 ' N ' ' O ' ' A' ' 23' ' ' PRO . 79.5 mtp85 -99.96 103.78 15.36 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.253 -0.904 . . . . 0.0 109.453 178.109 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 4.6 t 63.49 139.7 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.189 -0.944 . . . . 0.0 109.463 -179.767 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 137.97 145.88 4.95 Favored Glycine 0 N--CA 1.489 2.173 0 N-CA-C 109.605 -1.398 . . . . 0.0 109.605 -179.778 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 97.6 mt -72.47 -48.34 41.6 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.229 -1.159 . . . . 0.0 109.48 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.532 ' O ' ' O ' ' A' ' 30' ' ' ALA . 4.4 m -72.03 0.6 9.04 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.253 -0.904 . . . . 0.0 109.496 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.532 ' O ' ' O ' ' A' ' 29' ' ' SER . . . -42.5 170.43 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.297 -0.877 . . . . 0.0 109.519 179.755 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.452 ' H ' ' HD2' ' A' ' 24' ' ' ARG . . . 123.53 -22.37 6.98 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 -179.63 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 74.0 m80 -127.52 -162.27 1.15 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.294 -1.121 . . . . 0.0 109.489 179.37 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 84.8 mtt85 -111.62 128.05 55.93 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.228 -0.92 . . . . 0.0 109.461 179.818 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 97.1 m-20 -91.37 140.28 29.92 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.135 -0.978 . . . . 0.0 109.461 -179.575 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.533 HG11 ' NH2' ' A' ' 19' ' ' ARG . 21.5 t -106.08 132.85 52.13 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.272 -0.893 . . . . 0.0 109.436 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.526 ' CD1' ' NZ ' ' A' ' 44' ' ' LYS . 78.4 m-85 -120.96 142.23 49.94 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.299 -0.876 . . . . 0.0 109.444 179.634 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -112.31 146.36 38.39 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.299 -0.876 . . . . 0.0 109.536 -179.642 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 87.7 m-85 -126.49 139.98 52.81 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.176 -0.953 . . . . 0.0 109.529 179.668 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.412 ' CB ' ' HD2' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -100.44 165.18 14.87 Favored Pre-proline 0 N--CA 1.489 1.502 0 O-C-N 121.223 -0.923 . . . . 0.0 109.418 179.644 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.412 ' HD2' ' CB ' ' A' ' 39' ' ' SER . 18.8 Cg_endo -58.81 -19.37 46.43 Favored 'Trans proline' 0 C--N 1.306 -1.685 0 C-N-CA 122.783 2.322 . . . . 0.0 112.258 179.705 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 3.0 p -89.98 -0.91 57.84 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.291 -0.88 . . . . 0.0 109.433 179.725 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 86.61 14.65 65.17 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.506 -1.438 . . . . 0.0 109.506 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -80.35 117.42 21.09 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.296 -1.12 . . . . 0.0 109.511 -179.633 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.526 ' NZ ' ' CD1' ' A' ' 36' ' ' PHE . 61.5 tttm -92.57 128.86 38.58 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.297 -0.877 . . . . 0.0 109.396 178.765 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.624 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 1.0 OUTLIER -139.71 147.25 40.66 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.222 -0.924 . . . . 0.0 109.457 -179.716 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.623 ' NE ' ' O ' ' A' ' 46' ' ' ARG . 0.6 OUTLIER -137.36 62.12 1.6 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.161 -0.962 . . . . 0.0 109.53 179.635 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -150.14 133.34 16.31 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.306 -0.871 . . . . 0.0 109.433 179.871 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.599 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 1.1 tmtp? -55.42 -46.79 99.65 Favored Pre-proline 0 N--CA 1.491 1.59 0 O-C-N 121.238 -0.913 . . . . 0.0 109.437 -179.599 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.599 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 51.8 Cg_exo -53.7 -35.28 77.56 Favored 'Trans proline' 0 C--N 1.306 -1.685 0 C-N-CA 122.813 2.342 . . . . 0.0 112.234 -179.799 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.581 ' OE1' ' NH2' ' A' ' 53' ' ' ARG . 3.6 mm100 -67.09 -36.85 82.86 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.246 -0.909 . . . . 0.0 109.554 179.821 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.475 ' CD2' ' N ' ' A' ' 51' ' ' LEU . 3.8 mm? -66.4 -53.9 30.56 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.153 -0.967 . . . . 0.0 109.457 -179.046 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.617 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -66.97 -47.7 70.77 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.331 -0.855 . . . . 0.0 109.511 -178.521 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.581 ' NH2' ' OE1' ' A' ' 50' ' ' GLN . 57.3 ttp180 -59.21 -45.06 92.11 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.278 -0.889 . . . . 0.0 109.463 -178.839 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -69.7 -54.48 13.6 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.334 -0.854 . . . . 0.0 109.468 -179.211 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.675 HD11 ' HG3' ' A' ' 14' ' ' PRO . 1.8 mm? -80.42 -0.58 37.74 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.271 -0.893 . . . . 0.0 109.487 -179.462 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.919 ' O ' ' N ' ' A' ' 58' ' ' SER . . . -51.39 -176.13 0.03 OUTLIER Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.514 -1.434 . . . . 0.0 109.514 179.641 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 43.9 -69.81 0.0 OUTLIER Glycine 0 N--CA 1.491 2.337 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.919 ' N ' ' O ' ' A' ' 56' ' ' GLY . 82.8 p -57.72 -30.89 65.91 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.29 -1.123 . . . . 0.0 109.441 -178.244 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.443 ' O ' ' O ' ' A' ' 55' ' ' LEU . 1.3 mmm -167.29 160.19 13.33 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.209 -0.932 . . . . 0.0 109.493 -179.419 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 45.2 t0 -109.59 129.08 55.61 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.201 -0.937 . . . . 0.0 109.441 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 94.4 mt -114.65 16.12 17.55 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.193 -0.942 . . . . 0.0 109.427 -179.173 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 12.0 t -58.03 -38.04 75.48 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.257 -0.902 . . . . 0.0 109.462 179.825 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 17.9 p -87.9 19.62 3.46 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.266 -0.896 . . . . 0.0 109.5 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 60.0 t80 -88.52 132.38 34.53 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.213 -0.929 . . . . 0.0 109.458 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.51 ' HB2' HD23 ' A' ' 72' ' ' LEU . 60.1 t0 -83.43 111.51 19.1 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.356 -0.84 . . . . 0.0 109.454 -179.39 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 15.6 t80 -76.63 -39.93 50.85 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.256 -0.903 . . . . 0.0 109.517 -179.792 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.548 ' H ' ' NE ' ' A' ' 67' ' ' ARG . 0.2 OUTLIER -63.83 -42.29 97.65 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.182 -0.949 . . . . 0.0 109.575 -179.16 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.447 ' OG1' ' OD2' ' A' ' 65' ' ' ASP . 27.5 p -98.43 -12.47 21.34 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.317 -0.864 . . . . 0.0 109.591 -179.359 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.445 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 63.21 39.87 98.41 Favored Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.526 -1.43 . . . . 0.0 109.526 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.479 ' H ' ' HB3' ' A' ' 65' ' ' ASP . 68.6 mttm -140.3 157.76 45.07 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.154 -1.204 . . . . 0.0 109.453 -179.523 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.591 ' HG3' ' HB2' ' A' ' 12' ' ' ALA . 68.4 mtp -86.02 132.21 34.1 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.257 -0.902 . . . . 0.0 109.556 179.805 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.51 HD23 ' HB2' ' A' ' 65' ' ' ASP . 4.0 mm? . . . . . 0 N--CA 1.491 1.612 0 O-C-N 121.301 -0.874 . . . . 0.0 109.472 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.528 4.799 0 N-CA-C 119.396 2.519 . . . . 0.0 119.396 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.426 ' O ' ' N ' ' A' ' 4' ' ' GLU . 4.0 p -89.52 4.67 48.49 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.25 -1.147 . . . . 0.0 109.535 179.693 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 99.8 mmm -70.98 52.06 0.15 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.338 -0.851 . . . . 0.0 109.42 -179.775 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.426 ' N ' ' O ' ' A' ' 2' ' ' SER . 24.2 tt0 66.46 15.07 10.0 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.172 -0.955 . . . . 0.0 109.508 179.623 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.6 mtt85 -163.68 112.56 1.24 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.324 -0.86 . . . . 0.0 109.411 179.534 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.425 ' HB2' ' CZ2' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -121.84 113.64 19.93 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.318 -0.863 . . . . 0.0 109.441 -179.86 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.492 ' C ' ' CD ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -102.86 123.17 46.0 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.22 -0.925 . . . . 0.0 109.462 179.849 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.425 ' CZ2' ' HB2' ' A' ' 6' ' ' LYS . 7.7 m0 -125.76 175.21 7.78 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.284 -0.885 . . . . 0.0 109.458 179.844 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 31.2 tp10 -81.15 155.12 26.37 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.271 -0.893 . . . . 0.0 109.526 179.686 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.554 ' SG ' ' N ' ' A' ' 19' ' ' ARG . 3.4 m -114.3 100.51 52.95 Favored Pre-proline 0 N--CA 1.49 1.562 0 O-C-N 121.29 -0.881 . . . . 0.0 109.395 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -53.64 -38.04 84.01 Favored 'Trans proline' 0 C--N 1.305 -1.727 0 C-N-CA 122.879 2.386 . . . . 0.0 112.255 179.437 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.0 -39.5 78.43 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.225 -0.922 . . . . 0.0 109.529 -179.522 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.574 ' CD2' ' N ' ' A' ' 13' ' ' LEU . 2.5 mm? -91.63 155.78 43.53 Favored Pre-proline 0 N--CA 1.489 1.499 0 O-C-N 121.2 -0.937 . . . . 0.0 109.546 179.896 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -55.59 160.27 9.62 Favored 'Trans proline' 0 C--N 1.303 -1.819 0 C-N-CA 122.905 2.403 . . . . 0.0 112.228 -179.591 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 59.3 tt0 -54.63 125.32 19.34 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.206 -0.934 . . . . 0.0 109.466 -179.166 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 125.23 -20.99 6.54 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.601 -1.4 . . . . 0.0 109.601 179.259 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' TRP . . . . . 0.401 ' CG ' ' HB3' ' A' ' 13' ' ' LEU . 34.9 m95 -89.59 140.9 29.09 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.196 -1.179 . . . . 0.0 109.488 178.875 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.577 ' N ' ' OE1' ' A' ' 18' ' ' GLU . 54.5 mp0 -135.8 152.8 51.46 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.269 -0.895 . . . . 0.0 109.508 -179.09 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.554 ' N ' ' SG ' ' A' ' 10' ' ' CYS . 4.8 ptm85 -118.52 161.24 20.35 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.269 -0.894 . . . . 0.0 109.428 178.82 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.564 ' O ' HG13 ' A' ' 35' ' ' VAL . 79.1 tt0 -143.05 137.43 29.22 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.208 -0.932 . . . . 0.0 109.5 -179.351 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.427 ' HG2' HG22 ' A' ' 35' ' ' VAL . 99.2 mt-10 -110.91 131.0 55.42 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.241 -0.912 . . . . 0.0 109.334 -179.803 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.9 t -136.1 123.27 14.5 Favored Pre-proline 0 N--CA 1.49 1.528 0 O-C-N 121.165 -0.959 . . . . 0.0 109.549 -179.838 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -75.76 135.51 17.8 Favored 'Trans proline' 0 C--N 1.304 -1.791 0 C-N-CA 122.816 2.344 . . . . 0.0 112.209 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.45 ' HG2' ' H ' ' A' ' 25' ' ' ARG . 35.8 ttm180 -92.41 169.78 10.29 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.237 -0.914 . . . . 0.0 109.429 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.45 ' H ' ' HG2' ' A' ' 24' ' ' ARG . 90.3 mtm-85 -126.47 125.09 41.52 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.157 -0.964 . . . . 0.0 109.544 179.568 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.469 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 14.0 t -168.63 159.06 9.75 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.265 -0.897 . . . . 0.0 109.427 -179.907 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -66.09 -86.76 0.07 OUTLIER Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.55 -1.42 . . . . 0.0 109.55 -179.65 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.628 ' H ' HD23 ' A' ' 28' ' ' LEU . 0.1 OUTLIER -69.3 -34.13 74.23 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.262 -1.14 . . . . 0.0 109.426 -179.317 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.1 m -78.73 14.62 1.26 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.23 -0.919 . . . . 0.0 109.421 -179.467 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.469 ' HB2' ' O ' ' A' ' 26' ' ' SER . . . -59.11 148.68 30.35 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.193 -0.942 . . . . 0.0 109.379 179.849 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 90.02 -16.15 57.75 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 179.732 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -59.95 111.63 1.55 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.328 -1.101 . . . . 0.0 109.441 179.796 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 62.4 ttp180 -114.14 126.19 54.8 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.28 -0.888 . . . . 0.0 109.419 -179.642 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.505 ' OD1' ' O ' ' A' ' 34' ' ' ASP . 3.5 p30 -107.25 141.46 38.52 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.224 -0.923 . . . . 0.0 109.403 -179.827 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.564 HG13 ' O ' ' A' ' 20' ' ' GLU . 35.1 t -114.89 131.91 65.68 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.143 -0.973 . . . . 0.0 109.426 -179.817 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -106.57 148.32 28.4 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.287 -0.883 . . . . 0.0 109.409 179.497 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.574 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 63.4 m-85 -116.1 147.18 41.58 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.302 -0.874 . . . . 0.0 109.439 -179.396 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -129.39 143.03 50.68 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.228 -0.92 . . . . 0.0 109.491 -179.446 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.429 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -97.88 176.57 1.98 Allowed Pre-proline 0 N--CA 1.491 1.575 0 O-C-N 121.347 -0.846 . . . . 0.0 109.428 179.784 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.429 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 48.6 Cg_exo -54.46 -28.53 54.83 Favored 'Trans proline' 0 C--N 1.305 -1.74 0 C-N-CA 122.888 2.392 . . . . 0.0 112.227 179.632 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 95.0 p -89.67 0.68 56.8 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.241 -0.912 . . . . 0.0 109.475 179.781 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 83.91 17.75 64.77 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 -179.681 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 61.0 tttp -70.5 122.58 19.95 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.25 -1.147 . . . . 0.0 109.479 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 63.7 tttm -92.39 125.83 37.22 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.222 -0.924 . . . . 0.0 109.531 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.591 ' HE2' HD21 ' A' ' 51' ' ' LEU . 3.3 p90 -140.32 146.99 39.2 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.225 -0.922 . . . . 0.0 109.466 -179.693 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 46' ' ' ARG . 6.3 ptm85 -139.31 59.28 1.61 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.359 -0.838 . . . . 0.0 109.433 179.138 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.3 m -152.38 131.84 12.96 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.188 -0.945 . . . . 0.0 109.52 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.614 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 3.2 tmtp? -61.2 -45.39 95.54 Favored Pre-proline 0 N--CA 1.489 1.505 0 O-C-N 121.221 -0.924 . . . . 0.0 109.413 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.614 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 42.7 Cg_exo -55.69 -43.39 58.04 Favored 'Trans proline' 0 C--N 1.305 -1.747 0 C-N-CA 122.807 2.338 . . . . 0.0 112.224 179.58 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -65.02 -36.46 84.46 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.229 -0.919 . . . . 0.0 109.542 179.408 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.591 HD21 ' HE2' ' A' ' 45' ' ' PHE . 15.1 mt -62.11 -44.29 96.97 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.32 -0.863 . . . . 0.0 109.491 -179.829 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.708 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -77.2 -46.61 22.71 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.223 -0.923 . . . . 0.0 109.502 -179.865 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 14.1 tpp180 -54.15 -26.57 28.42 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.152 -0.967 . . . . 0.0 109.505 -179.519 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 68.1 t80 -97.59 -53.39 3.45 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.295 -0.878 . . . . 0.0 109.519 -179.485 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.424 ' C ' ' H ' ' A' ' 57' ' ' GLY . 3.4 tp -106.93 -4.6 18.94 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.197 -0.939 . . . . 0.0 109.497 -178.005 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.708 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -61.61 -2.38 3.32 Favored Glycine 0 N--CA 1.489 2.213 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 -179.789 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' GLY . . . . . 0.424 ' H ' ' C ' ' A' ' 55' ' ' LEU . . . -99.17 -52.18 1.27 Allowed Glycine 0 N--CA 1.491 2.318 0 N-CA-C 109.526 -1.429 . . . . 0.0 109.526 -179.842 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 9.3 m -77.86 -10.43 59.56 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.265 -1.138 . . . . 0.0 109.524 179.905 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 52.1 ttm -159.19 152.07 21.94 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.222 -0.924 . . . . 0.0 109.483 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.477 ' OD1' ' OG ' ' A' ' 62' ' ' SER . 59.6 t0 -91.27 110.82 22.12 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.253 -0.904 . . . . 0.0 109.476 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.567 HD22 ' N ' ' A' ' 61' ' ' LEU . 3.8 mm? -93.72 -1.07 55.62 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.334 -0.854 . . . . 0.0 109.445 -179.929 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.477 ' OG ' ' OD1' ' A' ' 60' ' ' ASP . 94.1 p -57.63 -37.47 73.37 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.265 -0.897 . . . . 0.0 109.55 179.609 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 48.3 p -91.75 10.15 29.59 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.196 -0.94 . . . . 0.0 109.549 -179.941 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -87.51 132.7 33.94 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.204 -0.935 . . . . 0.0 109.487 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.478 ' CG ' ' OG1' ' A' ' 68' ' ' THR . 55.3 t0 -85.49 110.81 19.45 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.298 -0.876 . . . . 0.0 109.543 -179.835 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.574 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 81.7 t80 -77.2 -41.32 41.85 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.269 -0.895 . . . . 0.0 109.482 -179.402 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 16.5 tpp180 -63.19 -42.53 99.35 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.265 -0.897 . . . . 0.0 109.501 -179.177 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.478 ' OG1' ' CG ' ' A' ' 65' ' ' ASP . 25.5 p -96.22 -13.4 23.48 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.297 -0.877 . . . . 0.0 109.473 -179.529 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.409 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 62.54 41.87 99.75 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.415 -1.474 . . . . 0.0 109.415 179.731 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.436 ' H ' ' HB3' ' A' ' 65' ' ' ASP . 98.5 mttt -134.54 147.87 50.39 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.222 -1.164 . . . . 0.0 109.43 -179.717 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 34.2 ttm -89.86 125.17 35.23 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.217 -0.927 . . . . 0.0 109.561 -179.888 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 2.3 pp . . . . . 0 N--CA 1.489 1.52 0 O-C-N 121.223 -0.923 . . . . 0.0 109.519 179.833 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.528 4.782 0 N-CA-C 119.323 2.489 . . . . 0.0 119.323 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 83.0 p -166.57 127.2 1.65 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.243 -1.151 . . . . 0.0 109.443 179.923 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 7.8 ptp -85.3 122.41 29.43 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.3 -0.875 . . . . 0.0 109.391 179.836 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 -97.89 144.0 27.9 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.295 -0.878 . . . . 0.0 109.479 179.853 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.443 ' HB3' HG22 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -72.38 171.7 11.74 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.208 -0.932 . . . . 0.0 109.443 179.861 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.621 ' NZ ' ' O ' ' A' ' 21' ' ' GLU . 0.3 OUTLIER -115.61 110.39 19.13 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.207 -0.933 . . . . 0.0 109.493 179.864 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 86.3 mtm180 -93.5 112.37 24.26 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.365 -0.834 . . . . 0.0 109.483 -179.819 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 11.9 m0 -105.26 160.16 15.32 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.267 -0.896 . . . . 0.0 109.376 179.355 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -77.2 139.4 39.88 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.179 -0.95 . . . . 0.0 109.455 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.541 ' SG ' HD23 ' A' ' 13' ' ' LEU . 2.4 t -106.12 102.49 40.09 Favored Pre-proline 0 N--CA 1.49 1.528 0 O-C-N 121.269 -0.894 . . . . 0.0 109.548 179.309 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -72.48 -13.26 27.6 Favored 'Trans proline' 0 C--N 1.304 -1.764 0 C-N-CA 122.838 2.359 . . . . 0.0 112.265 -178.521 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.572 ' C ' HD22 ' A' ' 13' ' ' LEU . . . -82.65 -20.11 36.91 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.181 -0.949 . . . . 0.0 109.494 -179.682 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.673 HD22 ' N ' ' A' ' 13' ' ' LEU . 3.8 mm? -101.13 157.93 32.74 Favored Pre-proline 0 N--CA 1.49 1.55 0 O-C-N 121.222 -0.924 . . . . 0.0 109.465 -179.873 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -52.69 144.67 41.99 Favored 'Trans proline' 0 C--N 1.305 -1.742 0 C-N-CA 122.804 2.336 . . . . 0.0 112.188 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -47.19 123.33 5.33 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.281 -0.887 . . . . 0.0 109.445 -179.524 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 124.02 -21.77 6.9 Favored Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.647 -1.381 . . . . 0.0 109.647 179.67 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' TRP . . . . . 0.406 ' CZ3' ' CZ ' ' A' ' 45' ' ' PHE . 21.3 m95 -85.42 146.68 26.86 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.225 -1.162 . . . . 0.0 109.439 179.505 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -132.13 149.32 52.43 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.194 -0.941 . . . . 0.0 109.451 -179.554 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.547 ' HE ' HG11 ' A' ' 35' ' ' VAL . 77.7 ttt-85 -114.92 157.44 23.36 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.188 -0.945 . . . . 0.0 109.497 179.416 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.673 ' OE1' HG23 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -152.5 153.68 33.97 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.248 -0.908 . . . . 0.0 109.494 -179.092 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.621 ' O ' ' NZ ' ' A' ' 6' ' ' LYS . 79.2 tt0 -119.5 131.28 55.54 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.331 -0.856 . . . . 0.0 109.338 179.318 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.673 HG23 ' OE1' ' A' ' 20' ' ' GLU . 7.6 t -130.28 125.35 21.75 Favored Pre-proline 0 N--CA 1.489 1.517 0 O-C-N 121.218 -0.926 . . . . 0.0 109.6 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -73.76 122.63 7.91 Favored 'Trans proline' 0 C--N 1.304 -1.81 0 C-N-CA 122.804 2.336 . . . . 0.0 112.156 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.746 ' HE ' ' H ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -77.44 157.98 30.24 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.199 -0.938 . . . . 0.0 109.473 -179.716 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.746 ' H ' ' HE ' ' A' ' 24' ' ' ARG . 17.5 ptm180 -142.79 144.63 32.66 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.208 -0.933 . . . . 0.0 109.521 -179.602 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -179.17 -67.93 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.244 -0.91 . . . . 0.0 109.438 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 177.73 -84.87 0.07 OUTLIER Glycine 0 N--CA 1.489 2.219 0 N-CA-C 109.591 -1.403 . . . . 0.0 109.591 -179.709 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 98.0 mt -62.64 -41.83 99.26 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.279 -1.13 . . . . 0.0 109.441 179.861 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 6.4 p -100.7 29.98 4.22 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.251 -0.906 . . . . 0.0 109.479 179.326 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -72.27 110.67 6.87 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.362 -0.836 . . . . 0.0 109.418 -179.738 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 123.33 -6.54 9.25 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 13.4 m170 -60.89 152.46 27.36 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.301 -1.117 . . . . 0.0 109.406 179.348 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 38.2 mmm-85 -112.27 109.07 18.52 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.254 -0.904 . . . . 0.0 109.508 -179.395 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -94.22 141.13 28.91 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.193 -0.942 . . . . 0.0 109.39 179.827 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.547 HG11 ' HE ' ' A' ' 19' ' ' ARG . 49.0 t -107.32 132.11 55.65 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.282 -0.887 . . . . 0.0 109.4 -179.152 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 -122.4 145.88 47.86 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.208 -0.933 . . . . 0.0 109.469 178.598 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.672 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 63.6 m-85 -119.02 151.52 38.07 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.311 -0.868 . . . . 0.0 109.382 -179.275 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 47.3 m-85 -123.7 139.9 53.53 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.187 -0.946 . . . . 0.0 109.518 179.638 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.451 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -95.37 177.28 1.85 Allowed Pre-proline 0 N--CA 1.49 1.561 0 O-C-N 121.33 -0.856 . . . . 0.0 109.539 179.178 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.451 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 48.3 Cg_exo -54.33 -29.21 56.9 Favored 'Trans proline' 0 C--N 1.304 -1.763 0 C-N-CA 122.838 2.359 . . . . 0.0 112.116 179.92 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 20.9 t -90.46 -1.55 57.9 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.251 -0.906 . . . . 0.0 109.499 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 86.46 22.51 47.12 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 75.5 tttt -75.42 127.17 32.52 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.193 -1.181 . . . . 0.0 109.453 -179.721 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.443 ' O ' ' HG3' ' A' ' 44' ' ' LYS . 21.3 ptmt -93.0 124.79 37.22 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.247 -0.908 . . . . 0.0 109.477 179.382 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.592 ' CE2' HD11 ' A' ' 51' ' ' LEU . 3.6 p90 -141.87 150.53 41.69 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.207 -0.933 . . . . 0.0 109.439 179.803 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.553 ' CD ' ' N ' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -135.66 67.02 1.49 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.262 -0.899 . . . . 0.0 109.472 179.708 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.3 m -157.15 116.87 3.43 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.304 -0.873 . . . . 0.0 109.403 179.551 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.584 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -53.78 -46.84 98.25 Favored Pre-proline 0 N--CA 1.489 1.52 0 O-C-N 121.256 -0.902 . . . . 0.0 109.542 -178.933 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.584 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 52.2 Cg_exo -54.35 -39.13 88.51 Favored 'Trans proline' 0 C--N 1.305 -1.717 0 C-N-CA 122.805 2.336 . . . . 0.0 112.202 179.433 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -61.54 -36.3 80.19 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.297 -0.877 . . . . 0.0 109.448 179.369 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.592 HD11 ' CE2' ' A' ' 45' ' ' PHE . 11.2 mp -66.46 -42.58 87.35 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.255 -0.903 . . . . 0.0 109.437 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -66.89 -50.41 62.54 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.174 -0.954 . . . . 0.0 109.471 -179.563 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.463 HH12 ' HB3' ' A' ' 49' ' ' PRO . 96.1 mtm-85 -60.18 -44.88 94.71 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.209 -0.932 . . . . 0.0 109.542 -179.378 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 67.8 t80 -65.81 -55.21 18.31 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.201 -0.937 . . . . 0.0 109.466 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 96.5 mt -61.45 -42.01 98.1 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.21 -0.931 . . . . 0.0 109.504 -179.849 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 93.94 -146.53 18.18 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 109.561 -1.416 . . . . 0.0 109.561 179.689 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -98.16 27.38 19.54 Favored Glycine 0 N--CA 1.492 2.381 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 179.761 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 13.0 m -89.42 -25.8 21.33 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.261 -1.141 . . . . 0.0 109.485 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 97.5 mtp -143.45 134.29 25.33 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.273 -0.892 . . . . 0.0 109.412 179.669 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -97.94 116.39 30.05 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.284 -0.885 . . . . 0.0 109.461 179.274 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.433 HD23 ' HA ' ' A' ' 61' ' ' LEU . 97.1 mt -95.82 2.75 53.95 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.119 -0.988 . . . . 0.0 109.469 -179.556 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 69.0 m -50.76 -39.01 51.2 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.255 -0.903 . . . . 0.0 109.506 179.644 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 31.4 p -94.6 39.67 1.09 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.254 -0.904 . . . . 0.0 109.52 179.229 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 85.0 t80 -125.75 125.67 43.35 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.257 -0.902 . . . . 0.0 109.437 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.603 ' O ' ' N ' ' A' ' 69' ' ' GLY . 89.3 m-20 -76.71 107.66 9.18 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.168 -0.958 . . . . 0.0 109.524 -179.609 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.672 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 54.5 t80 -74.78 -48.88 23.05 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.174 -0.953 . . . . 0.0 109.51 -179.821 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 18.3 mmm180 -54.72 -42.26 71.32 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.276 -0.89 . . . . 0.0 109.564 179.666 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 6.7 p -98.09 -14.35 20.51 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.169 -0.957 . . . . 0.0 109.462 -179.748 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.603 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 64.77 31.68 81.7 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 179.728 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.417 ' H ' ' HB2' ' A' ' 65' ' ' ASP . 72.0 mmtt -112.57 150.66 31.03 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.227 -1.16 . . . . 0.0 109.436 -179.803 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 11.9 tpp -93.86 123.97 37.56 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.197 -0.939 . . . . 0.0 109.484 179.848 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.484 ' C ' HD13 ' A' ' 72' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.573 0 O-C-N 121.135 -0.978 . . . . 0.0 109.458 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.529 4.853 0 N-CA-C 119.361 2.504 . . . . 0.0 119.361 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.6 p -72.26 163.78 27.38 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.233 -1.157 . . . . 0.0 109.45 179.584 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.612 ' O ' ' C ' ' A' ' 4' ' ' GLU . 14.8 ttt -77.99 91.27 4.22 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.217 -0.927 . . . . 0.0 109.374 -179.779 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.612 ' C ' ' O ' ' A' ' 3' ' ' MET . 5.3 pt-20 29.01 86.6 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.153 -0.967 . . . . 0.0 109.486 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 31.0 ptt180 -48.14 127.36 12.39 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.168 -0.957 . . . . 0.0 109.464 -179.543 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.426 ' HB2' ' H ' ' A' ' 21' ' ' GLU . 2.5 mmtp -63.06 147.8 49.68 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.352 -0.843 . . . . 0.0 109.501 -179.291 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 73.6 ttp85 -149.97 138.93 21.02 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.234 -0.916 . . . . 0.0 109.472 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.57 ' CD1' ' N ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -167.33 142.2 3.9 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.22 -0.925 . . . . 0.0 109.463 -179.828 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -103.64 142.45 34.3 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.241 -0.912 . . . . 0.0 109.458 178.517 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.818 ' SG ' HD13 ' A' ' 13' ' ' LEU . 0.8 OUTLIER -115.19 129.15 25.32 Favored Pre-proline 0 N--CA 1.49 1.568 0 O-C-N 121.311 -0.868 . . . . 0.0 109.461 -179.657 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -51.16 -24.26 14.59 Favored 'Trans proline' 0 C--N 1.305 -1.715 0 C-N-CA 122.901 2.401 . . . . 0.0 112.233 178.499 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.466 ' O ' ' SD ' ' A' ' 59' ' ' MET . . . -71.08 -16.44 62.58 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.196 -0.94 . . . . 0.0 109.496 -179.602 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.818 HD13 ' SG ' ' A' ' 10' ' ' CYS . 5.5 mp -102.01 148.95 36.08 Favored Pre-proline 0 N--CA 1.49 1.565 0 O-C-N 121.192 -0.943 . . . . 0.0 109.402 -179.894 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.465 ' HG2' ' CD1' ' A' ' 17' ' ' TRP . 37.3 Cg_endo -67.5 149.0 79.9 Favored 'Trans proline' 0 C--N 1.305 -1.726 0 C-N-CA 122.904 2.403 . . . . 0.0 112.17 179.876 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.618 ' O ' ' NE2' ' A' ' 15' ' ' GLN . 1.5 pm0 -54.44 125.98 21.65 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.294 -0.878 . . . . 0.0 109.506 -179.131 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 122.38 -29.12 5.58 Favored Glycine 0 N--CA 1.491 2.337 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 179.351 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' TRP . . . . . 0.603 ' CZ2' ' OG ' ' A' ' 39' ' ' SER . 17.0 m95 -89.23 155.42 19.41 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.213 -1.169 . . . . 0.0 109.452 179.363 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -149.63 164.54 34.89 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.142 -0.974 . . . . 0.0 109.429 -178.855 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.602 ' NH1' ' O ' ' A' ' 69' ' ' GLY . 13.0 mtm105 -132.69 131.99 41.89 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.245 -0.909 . . . . 0.0 109.476 178.772 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -136.48 141.54 43.49 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.175 -0.953 . . . . 0.0 109.562 -178.771 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.537 ' OE2' ' CZ ' ' A' ' 33' ' ' ARG . 80.4 tt0 -102.43 147.01 27.25 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.315 -0.866 . . . . 0.0 109.358 179.022 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.5 t -149.31 127.59 5.9 Favored Pre-proline 0 N--CA 1.49 1.535 0 O-C-N 121.184 -0.948 . . . . 0.0 109.65 -178.603 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -77.33 140.07 19.16 Favored 'Trans proline' 0 C--N 1.306 -1.707 0 C-N-CA 122.851 2.367 . . . . 0.0 112.167 178.629 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.573 ' NE ' ' OD1' ' A' ' 34' ' ' ASP . 99.2 mtt180 -68.84 153.56 43.57 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.186 -0.947 . . . . 0.0 109.534 179.526 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 89.6 mtm180 -129.45 -28.09 2.34 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.243 -0.911 . . . . 0.0 109.525 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 44.1 t -144.1 112.45 6.44 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.314 -0.866 . . . . 0.0 109.545 -179.731 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 171.83 170.23 35.56 Favored Glycine 0 N--CA 1.491 2.3 0 N-CA-C 109.619 -1.392 . . . . 0.0 109.619 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.493 ' N ' HD12 ' A' ' 28' ' ' LEU . 11.0 mp -62.58 -41.53 99.01 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.199 -1.177 . . . . 0.0 109.502 179.871 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.484 ' O ' ' C ' ' A' ' 30' ' ' ALA . 6.1 m -93.37 14.13 19.38 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.343 -0.848 . . . . 0.0 109.377 -179.784 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.484 ' C ' ' O ' ' A' ' 29' ' ' SER . . . -40.11 133.75 1.67 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.254 -0.904 . . . . 0.0 109.465 179.734 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 122.71 -34.85 3.62 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.499 -1.44 . . . . 0.0 109.499 -179.735 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -80.5 174.15 11.9 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.221 -1.164 . . . . 0.0 109.554 179.586 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.537 ' CZ ' ' OE2' ' A' ' 21' ' ' GLU . 83.7 mtp180 -120.25 136.72 54.56 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.256 -0.903 . . . . 0.0 109.415 -179.721 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.573 ' OD1' ' NE ' ' A' ' 24' ' ' ARG . 4.6 m-20 -122.74 143.5 49.78 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.239 -0.913 . . . . 0.0 109.419 -179.709 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 65.5 t -105.9 136.1 41.55 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 O-C-N 121.244 -0.91 . . . . 0.0 109.442 179.816 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -122.27 147.08 46.66 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.358 -0.838 . . . . 0.0 109.51 179.857 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.453 ' CB ' ' CE2' ' A' ' 45' ' ' PHE . 8.5 m-85 -112.71 139.32 48.42 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.251 -0.906 . . . . 0.0 109.455 -179.878 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 74.7 m-85 -114.33 128.44 56.35 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.221 -0.924 . . . . 0.0 109.575 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.603 ' OG ' ' CZ2' ' A' ' 17' ' ' TRP . 0.1 OUTLIER -97.61 177.28 1.69 Allowed Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.279 -0.888 . . . . 0.0 109.447 179.251 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.444 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 52.8 Cg_exo -53.76 -30.39 56.57 Favored 'Trans proline' 0 C--N 1.306 -1.677 0 C-N-CA 122.904 2.402 . . . . 0.0 112.24 179.402 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 96.4 p -87.52 4.97 41.42 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.317 -0.864 . . . . 0.0 109.461 179.56 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 74.9 12.86 82.94 Favored Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 179.755 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 5.4 ttmt -73.32 131.27 41.72 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.24 -1.153 . . . . 0.0 109.452 -179.862 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 16.9 pttp -94.7 130.05 41.36 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.247 -0.908 . . . . 0.0 109.447 179.195 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.668 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 0.7 OUTLIER -139.53 146.3 39.74 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.271 -0.893 . . . . 0.0 109.399 -179.918 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 46.0 ptt85 -139.88 53.07 1.68 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.367 -0.833 . . . . 0.0 109.506 -179.795 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.4 p -150.93 134.99 16.73 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.281 -0.887 . . . . 0.0 109.464 179.573 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.607 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 0.9 OUTLIER -58.42 -46.13 99.64 Favored Pre-proline 0 N--CA 1.49 1.563 0 O-C-N 121.216 -0.927 . . . . 0.0 109.461 179.887 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.607 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 52.2 Cg_exo -53.16 -43.23 58.92 Favored 'Trans proline' 0 C--N 1.305 -1.717 0 C-N-CA 122.836 2.357 . . . . 0.0 112.189 -179.655 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -68.19 -33.94 75.36 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.248 -0.907 . . . . 0.0 109.522 179.096 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.635 HD13 ' O ' ' A' ' 51' ' ' LEU . 0.3 OUTLIER -59.37 -49.68 76.88 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.246 -0.909 . . . . 0.0 109.488 179.65 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -71.77 -37.6 70.45 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.183 -0.948 . . . . 0.0 109.55 -179.566 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 42.3 ttm180 -56.22 -51.08 69.4 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.247 -0.908 . . . . 0.0 109.558 -179.336 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.441 ' C ' ' H ' ' A' ' 56' ' ' GLY . 18.4 t80 -68.51 -50.03 55.17 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.368 -0.833 . . . . 0.0 109.503 -179.708 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.436 ' O ' ' OG ' ' A' ' 58' ' ' SER . 4.2 mm? -64.23 1.2 0.78 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.144 -0.972 . . . . 0.0 109.444 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.548 ' O ' ' C ' ' A' ' 57' ' ' GLY . . . 51.91 64.0 4.31 Favored Glycine 0 N--CA 1.492 2.384 0 N-CA-C 109.46 -1.456 . . . . 0.0 109.46 179.794 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' GLY . . . . . 0.548 ' C ' ' O ' ' A' ' 56' ' ' GLY . . . 33.82 36.0 0.05 OUTLIER Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.556 -1.417 . . . . 0.0 109.556 -179.515 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.53 ' N ' ' O ' ' A' ' 56' ' ' GLY . 74.2 m -85.24 -0.58 55.1 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.21 -1.171 . . . . 0.0 109.486 179.746 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.466 ' SD ' ' O ' ' A' ' 12' ' ' ALA . 40.6 ttp -157.34 149.69 22.86 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.351 -0.843 . . . . 0.0 109.497 -179.869 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 91.1 m-20 -86.34 106.35 17.33 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.292 -0.88 . . . . 0.0 109.405 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.6 HD22 ' N ' ' A' ' 61' ' ' LEU . 3.7 mm? -89.61 -4.89 57.62 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.222 -0.924 . . . . 0.0 109.462 -179.933 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 37.9 m -58.49 -33.89 70.3 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.297 -0.877 . . . . 0.0 109.532 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 17.9 p -96.45 9.22 42.01 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.178 -0.951 . . . . 0.0 109.48 -179.82 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 89.7 t80 -90.24 135.12 33.87 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.225 -0.922 . . . . 0.0 109.419 179.807 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.515 ' O ' ' N ' ' A' ' 69' ' ' GLY . 9.8 m-20 -85.67 111.29 19.95 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.248 -0.908 . . . . 0.0 109.582 179.818 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 77.4 t80 -75.16 -47.64 27.45 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.211 -0.931 . . . . 0.0 109.392 -179.286 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.45 ' HA ' ' HE ' ' A' ' 67' ' ' ARG . 0.3 OUTLIER -56.4 -43.84 79.7 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.251 -0.906 . . . . 0.0 109.474 -179.351 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 30.0 p -94.51 -15.38 24.21 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.165 -0.959 . . . . 0.0 109.515 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.602 ' O ' ' NH1' ' A' ' 19' ' ' ARG . . . 63.69 35.68 92.35 Favored Glycine 0 N--CA 1.49 2.239 0 N-CA-C 109.568 -1.413 . . . . 0.0 109.568 179.797 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 54.8 mtpt -125.61 151.35 46.6 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.329 -1.101 . . . . 0.0 109.529 -179.543 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 10.8 tpp -93.54 121.78 35.3 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.257 -0.902 . . . . 0.0 109.405 179.812 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 56.4 tp . . . . . 0 N--CA 1.49 1.559 0 O-C-N 121.179 -0.951 . . . . 0.0 109.416 179.876 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 33.8 ptt180 . . . . . 0 N--CA 1.49 1.561 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 12.6 mttp -85.26 169.89 13.35 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.25 -0.907 . . . . 0.0 109.539 179.209 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.547 ' NH1' ' OE2' ' A' ' 20' ' ' GLU . 61.8 ttt85 -155.87 95.04 1.6 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.207 -0.933 . . . . 0.0 109.441 -178.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 7.7 m0 -111.24 139.41 46.64 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.247 -0.908 . . . . 0.0 109.475 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -83.43 149.67 26.53 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.276 -0.89 . . . . 0.0 109.467 179.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 34.3 m -114.75 100.46 53.39 Favored Pre-proline 0 N--CA 1.491 1.587 0 O-C-N 121.203 -0.935 . . . . 0.0 109.492 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -55.56 -27.21 58.75 Favored 'Trans proline' 0 C--N 1.305 -1.748 0 C-N-CA 122.877 2.385 . . . . 0.0 112.272 178.3 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.41 -34.48 74.01 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.257 -0.902 . . . . 0.0 109.474 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.413 ' N ' HD23 ' A' ' 13' ' ' LEU . 9.4 mt -90.15 157.46 45.37 Favored Pre-proline 0 N--CA 1.489 1.524 0 O-C-N 121.18 -0.95 . . . . 0.0 109.376 -179.812 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_exo -54.8 145.26 62.08 Favored 'Trans proline' 0 C--N 1.305 -1.723 0 C-N-CA 122.848 2.365 . . . . 0.0 112.185 179.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 94.4 mm-40 -49.57 127.85 16.38 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.323 -0.861 . . . . 0.0 109.463 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 123.88 -18.35 7.55 Favored Glycine 0 N--CA 1.49 2.24 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . 0.405 ' N ' ' CD1' ' A' ' 17' ' ' TRP . 21.1 m95 -93.0 150.74 20.33 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.259 -1.142 . . . . 0.0 109.468 179.14 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.509 ' OE1' ' N ' ' A' ' 18' ' ' GLU . 59.4 mp0 -144.42 160.91 40.28 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.227 -0.92 . . . . 0.0 109.463 -179.474 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.533 ' CZ ' HG11 ' A' ' 35' ' ' VAL . 33.6 ttt180 -121.2 156.88 31.45 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.221 -0.924 . . . . 0.0 109.42 179.286 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.547 ' OE2' ' NH1' ' A' ' 7' ' ' ARG . 95.9 mt-10 -147.23 142.59 27.39 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.221 -0.924 . . . . 0.0 109.524 -179.662 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 80.2 tt0 -115.18 133.85 55.67 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.277 -0.889 . . . . 0.0 109.456 179.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.6 t -129.09 123.29 21.67 Favored Pre-proline 0 N--CA 1.491 1.589 0 O-C-N 121.272 -0.893 . . . . 0.0 109.538 -178.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -77.04 129.86 10.85 Favored 'Trans proline' 0 C--N 1.306 -1.701 0 C-N-CA 122.868 2.379 . . . . 0.0 112.145 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 23.3 mmm180 . . . . . 0 N--CA 1.491 1.585 0 O-C-N 121.185 -0.947 . . . . 0.0 109.424 179.973 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 . . . . . 0 N--CA 1.491 1.575 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 84.7 mtm-85 -115.64 127.61 55.32 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.246 -0.909 . . . . 0.0 109.556 -179.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.451 ' OD1' ' N ' ' A' ' 35' ' ' VAL . 62.8 t0 -106.12 142.55 35.63 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.229 -0.919 . . . . 0.0 109.417 -179.902 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.533 HG11 ' CZ ' ' A' ' 19' ' ' ARG . 46.9 t -111.03 129.4 66.36 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.246 -0.909 . . . . 0.0 109.413 -179.592 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -116.69 145.37 43.49 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.255 -0.903 . . . . 0.0 109.514 179.118 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.627 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 60.2 m-85 -115.05 149.8 36.91 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.273 -0.892 . . . . 0.0 109.472 179.638 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 94.9 m-85 -127.76 140.39 52.09 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.246 -0.909 . . . . 0.0 109.518 179.397 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.47 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -97.91 178.35 1.36 Allowed Pre-proline 0 N--CA 1.489 1.509 0 O-C-N 121.242 -0.911 . . . . 0.0 109.504 179.452 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.47 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 35.6 Cg_exo -56.6 -29.31 78.66 Favored 'Trans proline' 0 C--N 1.305 -1.727 0 C-N-CA 122.826 2.351 . . . . 0.0 112.206 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 91.4 p -87.39 -0.92 57.5 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.164 -0.96 . . . . 0.0 109.485 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 83.53 22.2 56.71 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -74.8 126.06 30.12 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.262 -1.14 . . . . 0.0 109.454 179.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -94.33 121.55 35.97 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.275 -0.89 . . . . 0.0 109.542 179.447 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.636 ' N ' ' CD1' ' A' ' 45' ' ' PHE . 1.2 p90 -141.36 149.83 41.65 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.214 -0.929 . . . . 0.0 109.506 -179.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.93 68.62 1.42 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.256 -0.903 . . . . 0.0 109.464 179.247 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 44.9 m -151.06 130.71 13.09 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.279 -0.888 . . . . 0.0 109.466 179.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.736 ' N ' ' HD2' ' A' ' 49' ' ' PRO . 20.3 tttt -60.73 -53.92 59.61 Favored Pre-proline 0 N--CA 1.49 1.54 0 O-C-N 121.288 -0.882 . . . . 0.0 109.457 -179.517 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.736 ' HD2' ' N ' ' A' ' 48' ' ' LYS . 10.9 Cg_endo -52.99 -38.53 80.02 Favored 'Trans proline' 0 C--N 1.304 -1.766 0 C-N-CA 122.853 2.369 . . . . 0.0 112.203 -179.521 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -64.66 -36.95 85.91 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.205 -0.934 . . . . 0.0 109.521 178.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 4.1 mt -64.75 -44.53 89.8 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.284 -0.885 . . . . 0.0 109.429 179.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.696 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -73.79 -45.57 50.78 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.213 -0.929 . . . . 0.0 109.485 -179.219 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -60.88 -44.52 96.97 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.265 -0.897 . . . . 0.0 109.489 -179.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 29.0 t80 -66.8 -54.17 25.38 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.312 -0.868 . . . . 0.0 109.492 -179.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 94.6 mt -91.84 10.58 28.02 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.224 -0.923 . . . . 0.0 109.479 -179.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . 0.696 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -49.61 -71.08 0.66 Allowed Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 -179.63 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -54.07 -44.06 73.25 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 109.568 -1.413 . . . . 0.0 109.568 -179.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 95.8 p -59.36 -29.66 67.84 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.231 -1.158 . . . . 0.0 109.463 -179.666 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.661 ' SD ' HD21 ' A' ' 61' ' ' LEU . 0.0 OUTLIER 179.5 173.38 0.86 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.229 -0.919 . . . . 0.0 109.479 -179.856 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 90.6 m-20 -102.24 123.48 46.15 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.287 -0.883 . . . . 0.0 109.477 179.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.661 HD21 ' SD ' ' A' ' 59' ' ' MET . 98.6 mt -116.88 13.69 15.03 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.236 -0.915 . . . . 0.0 109.483 -179.586 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 92.9 p -56.11 -33.9 65.55 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.27 -0.894 . . . . 0.0 109.475 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 21.5 p -92.88 19.77 7.32 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.218 -0.926 . . . . 0.0 109.519 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -88.57 135.6 33.41 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.204 -0.935 . . . . 0.0 109.445 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.518 ' O ' ' N ' ' A' ' 69' ' ' GLY . 51.8 t0 -87.38 111.56 21.22 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.192 -0.943 . . . . 0.0 109.481 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.627 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 74.6 t80 -75.91 -41.68 51.15 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.227 -0.92 . . . . 0.0 109.527 -179.323 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.422 ' HD2' ' N ' ' A' ' 67' ' ' ARG . 3.2 mpt_? -62.12 -39.51 92.78 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.199 -0.938 . . . . 0.0 109.494 -179.046 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . 0.458 ' OG1' ' CG ' ' A' ' 65' ' ' ASP . 44.0 p -103.05 -13.41 16.85 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.309 -0.869 . . . . 0.0 109.471 -178.447 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . 0.518 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 62.79 42.37 99.69 Favored Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.476 ' H ' ' HB3' ' A' ' 65' ' ' ASP . 68.6 mttm -132.71 154.5 50.12 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.227 -1.161 . . . . 0.0 109.488 -179.775 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 57.0 ttm -91.61 125.13 36.23 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.291 -0.881 . . . . 0.0 109.514 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 8.6 tp . . . . . 0 N--CA 1.489 1.525 0 O-C-N 121.259 -0.901 . . . . 0.0 109.479 179.85 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 85.0 mtp180 . . . . . 0 N--CA 1.489 1.507 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.436 ' O ' ' HA ' ' A' ' 20' ' ' GLU . 0.5 OUTLIER -111.14 106.18 15.13 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.264 -0.897 . . . . 0.0 109.53 179.917 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 56.0 ttp180 -102.13 118.12 36.22 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.181 -0.95 . . . . 0.0 109.34 -179.466 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.559 ' CD1' ' N ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -124.99 144.56 50.32 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.221 -0.924 . . . . 0.0 109.429 179.603 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -57.43 141.27 47.97 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.207 -0.933 . . . . 0.0 109.443 -179.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.5 ' SG ' ' C ' ' A' ' 17' ' ' TRP . 0.8 OUTLIER -96.64 123.03 55.52 Favored Pre-proline 0 N--CA 1.491 1.588 0 O-C-N 121.254 -0.904 . . . . 0.0 109.51 179.72 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -73.75 -32.87 7.02 Favored 'Trans proline' 0 C--N 1.304 -1.771 0 C-N-CA 122.88 2.387 . . . . 0.0 112.249 -178.77 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.0 -38.02 85.26 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.337 -0.852 . . . . 0.0 109.516 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.578 ' CD1' ' N ' ' A' ' 13' ' ' LEU . 5.1 mp -84.01 156.59 63.8 Favored Pre-proline 0 N--CA 1.49 1.566 0 O-C-N 121.277 -0.889 . . . . 0.0 109.52 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -49.72 155.75 3.63 Favored 'Trans proline' 0 C--N 1.306 -1.699 0 C-N-CA 122.774 2.316 . . . . 0.0 112.284 179.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -56.29 123.73 15.61 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.19 -0.944 . . . . 0.0 109.468 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 123.26 -33.99 3.82 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 179.445 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . 0.5 ' C ' ' SG ' ' A' ' 10' ' ' CYS . 49.8 m95 -71.31 149.59 45.97 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.308 -1.113 . . . . 0.0 109.481 179.222 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 68.3 mt-10 -145.32 157.98 43.93 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.345 -0.847 . . . . 0.0 109.54 -178.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.426 ' NH1' ' O ' ' A' ' 68' ' ' THR . 21.1 ptt180 -141.59 145.62 35.28 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.3 -0.875 . . . . 0.0 109.432 179.046 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.436 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 19.2 pt-20 -130.39 143.3 50.68 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.226 -0.921 . . . . 0.0 109.584 -179.385 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -98.59 136.99 37.89 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.267 -0.896 . . . . 0.0 109.471 178.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 30.7 t -143.13 100.92 5.3 Favored Pre-proline 0 N--CA 1.49 1.575 0 O-C-N 121.23 -0.919 . . . . 0.0 109.529 -179.172 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_exo -56.69 136.51 76.58 Favored 'Trans proline' 0 C--N 1.305 -1.726 0 C-N-CA 122.872 2.382 . . . . 0.0 112.185 177.388 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 23.0 ptt180 . . . . . 0 N--CA 1.491 1.598 0 O-C-N 121.239 -0.913 . . . . 0.0 109.491 179.825 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 28.9 m170 . . . . . 0 N--CA 1.49 1.531 0 N-CA-C 109.468 -0.568 . . . . 0.0 109.468 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 50.5 ptt85 -118.35 137.53 53.03 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.351 -0.843 . . . . 0.0 109.465 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.409 ' OD1' ' N ' ' A' ' 35' ' ' VAL . 64.0 t0 -104.16 133.92 48.27 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.26 -0.9 . . . . 0.0 109.438 -179.495 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.409 ' N ' ' OD1' ' A' ' 34' ' ' ASP . 57.7 t -109.68 132.91 56.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 O-C-N 121.26 -0.9 . . . . 0.0 109.442 179.379 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -111.72 141.81 44.87 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.233 -0.917 . . . . 0.0 109.388 -179.176 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.541 ' CE1' ' CZ ' ' A' ' 66' ' ' PHE . 44.1 m-85 -114.81 143.25 45.38 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.25 -0.907 . . . . 0.0 109.475 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 87.8 m-85 -122.91 133.34 54.41 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.182 -0.949 . . . . 0.0 109.513 -179.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.472 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.4 OUTLIER -98.59 178.59 1.26 Allowed Pre-proline 0 N--CA 1.491 1.576 0 O-C-N 121.262 -0.899 . . . . 0.0 109.486 179.58 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.472 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 48.7 Cg_exo -54.6 -29.92 62.99 Favored 'Trans proline' 0 C--N 1.305 -1.752 0 C-N-CA 122.853 2.369 . . . . 0.0 112.206 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 96.4 p -85.89 7.82 22.65 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.272 -0.892 . . . . 0.0 109.485 179.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 72.71 8.59 72.76 Favored Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 -179.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 3.8 tmmt? -67.49 128.99 38.49 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.298 -1.119 . . . . 0.0 109.492 -179.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 51.9 pttt -99.14 130.34 45.45 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.262 -0.899 . . . . 0.0 109.451 179.02 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.491 ' N ' ' CD1' ' A' ' 45' ' ' PHE . 9.8 p90 -141.69 149.19 40.24 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.306 -0.872 . . . . 0.0 109.479 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 25.7 ptt-85 -130.84 50.69 2.2 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.176 -0.952 . . . . 0.0 109.486 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -159.27 143.87 15.45 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.226 -0.921 . . . . 0.0 109.478 -179.888 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.633 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 10.6 tttt -60.14 -44.67 96.99 Favored Pre-proline 0 N--CA 1.489 1.501 0 O-C-N 121.205 -0.934 . . . . 0.0 109.515 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.633 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 47.3 Cg_exo -55.99 -38.69 94.33 Favored 'Trans proline' 0 C--N 1.305 -1.741 0 C-N-CA 122.855 2.37 . . . . 0.0 112.192 179.706 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 94.9 mm-40 -67.57 -37.97 83.4 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.259 -0.901 . . . . 0.0 109.482 179.535 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.46 ' CD1' ' CZ3' ' A' ' 17' ' ' TRP . 57.8 tp -61.04 -45.58 94.19 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.307 -0.871 . . . . 0.0 109.509 179.747 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.517 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -68.59 -40.37 80.51 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.241 -0.912 . . . . 0.0 109.392 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 77.7 ttt-85 -53.5 -44.65 69.25 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.328 -0.857 . . . . 0.0 109.478 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 50.5 t80 -66.31 -49.2 67.86 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.242 -0.911 . . . . 0.0 109.423 179.365 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.583 ' O ' ' N ' ' A' ' 57' ' ' GLY . 98.6 mt -80.75 4.87 17.5 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.25 -0.906 . . . . 0.0 109.454 179.753 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . 0.517 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . 60.11 -74.6 0.01 OUTLIER Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.561 -1.416 . . . . 0.0 109.561 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . 0.583 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . 177.28 37.66 0.06 OUTLIER Glycine 0 N--CA 1.49 2.241 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 -179.712 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 87.1 p -93.34 8.32 40.91 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.23 -1.159 . . . . 0.0 109.45 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 99.7 mtp -145.87 139.83 26.59 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.23 -0.918 . . . . 0.0 109.5 -179.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.404 ' OD1' ' N ' ' A' ' 60' ' ' ASP . 38.4 p-10 -80.53 96.02 6.67 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.103 -0.998 . . . . 0.0 109.494 179.572 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 90.1 mt -95.41 -1.83 50.19 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.286 -0.884 . . . . 0.0 109.48 -179.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 35.8 t -53.96 -29.83 44.37 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.182 -0.949 . . . . 0.0 109.505 179.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 69.4 p -106.91 18.49 21.75 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.302 -0.874 . . . . 0.0 109.527 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.437 ' O ' ' CE ' ' A' ' 48' ' ' LYS . 14.8 t80 -88.22 124.73 34.14 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.215 -0.928 . . . . 0.0 109.51 -179.746 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.415 ' O ' ' N ' ' A' ' 69' ' ' GLY . 7.8 m-20 -79.92 113.57 18.18 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.302 -0.874 . . . . 0.0 109.451 -179.535 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.541 ' CZ ' ' CE1' ' A' ' 37' ' ' TYR . 58.5 t80 -79.24 -42.21 26.45 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.293 -0.879 . . . . 0.0 109.442 -179.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 83.7 mmt-85 -62.86 -40.17 96.67 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.199 -0.938 . . . . 0.0 109.453 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . 0.426 ' O ' ' NH1' ' A' ' 19' ' ' ARG . 27.6 p -97.78 -13.62 21.26 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.335 -0.853 . . . . 0.0 109.472 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . 0.415 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 61.62 40.41 98.71 Favored Glycine 0 N--CA 1.489 2.204 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 -179.844 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -128.67 149.7 50.56 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.172 -1.193 . . . . 0.0 109.437 -179.627 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 36.6 ttm -94.12 112.86 24.71 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.267 -0.896 . . . . 0.0 109.397 179.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.437 HD22 ' HA ' ' A' ' 72' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.533 0 O-C-N 121.287 -0.883 . . . . 0.0 109.41 -179.88 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.4 tpt180 . . . . . 0 N--CA 1.491 1.578 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 31.1 mttt -79.4 169.69 17.7 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.291 -0.88 . . . . 0.0 109.462 -179.64 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.574 ' O ' ' CD1' ' A' ' 8' ' ' TRP . 79.0 mtp85 -143.66 135.12 26.08 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.324 -0.86 . . . . 0.0 109.455 -178.701 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.574 ' CD1' ' O ' ' A' ' 7' ' ' ARG . 6.3 m0 -157.85 129.09 6.63 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.207 -0.933 . . . . 0.0 109.438 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 45.8 tt0 -86.9 121.58 29.58 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.149 -0.97 . . . . 0.0 109.556 178.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.467 ' CA ' HH12 ' A' ' 19' ' ' ARG . 0.0 OUTLIER -79.61 123.85 83.97 Favored Pre-proline 0 N--CA 1.49 1.532 0 O-C-N 121.316 -0.865 . . . . 0.0 109.479 -179.444 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -71.8 -13.53 29.46 Favored 'Trans proline' 0 C--N 1.305 -1.721 0 C-N-CA 122.797 2.331 . . . . 0.0 112.235 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.563 ' HB3' ' CE1' ' A' ' 64' ' ' PHE . . . -82.64 -14.72 54.22 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.279 -0.888 . . . . 0.0 109.531 179.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.618 HD21 HD11 ' A' ' 51' ' ' LEU . 5.8 mp -100.38 156.07 35.66 Favored Pre-proline 0 N--CA 1.49 1.571 0 O-C-N 121.161 -0.962 . . . . 0.0 109.428 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . 0.577 ' CG ' HD11 ' A' ' 55' ' ' LEU . 31.5 Cg_exo -57.1 142.09 94.27 Favored 'Trans proline' 0 C--N 1.305 -1.741 0 C-N-CA 122.911 2.407 . . . . 0.0 112.202 178.791 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -47.77 128.82 13.6 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.323 -0.86 . . . . 0.0 109.411 179.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 117.83 -17.79 11.82 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 -179.617 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . 0.403 ' NE1' ' HD3' ' A' ' 40' ' ' PRO . 24.3 m95 -92.09 151.77 20.26 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.365 -1.079 . . . . 0.0 109.458 179.866 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -151.05 164.8 35.59 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.252 -0.905 . . . . 0.0 109.502 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.467 HH12 ' CA ' ' A' ' 10' ' ' CYS . 35.9 ptt-85 -142.7 149.13 38.41 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.29 -0.881 . . . . 0.0 109.509 179.331 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -124.51 162.94 22.93 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.26 -0.9 . . . . 0.0 109.509 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -117.54 135.66 53.79 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.302 -0.874 . . . . 0.0 109.388 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.4 t -131.32 115.2 16.15 Favored Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.261 -0.899 . . . . 0.0 109.546 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -76.58 142.02 22.81 Favored 'Trans proline' 0 C--N 1.304 -1.786 0 C-N-CA 122.91 2.407 . . . . 0.0 112.13 -179.262 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 23.0 mmt180 . . . . . 0 N--CA 1.49 1.546 0 O-C-N 121.247 -0.908 . . . . 0.0 109.579 179.734 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 31.6 m170 . . . . . 0 N--CA 1.489 1.522 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -108.78 111.94 23.96 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.316 -0.865 . . . . 0.0 109.495 -179.601 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 87.3 m-20 -84.69 139.3 32.11 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.285 -0.884 . . . . 0.0 109.433 179.086 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 42.6 t -113.82 128.74 70.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.298 -0.876 . . . . 0.0 109.453 -179.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.417 ' CE2' ' HD3' ' A' ' 46' ' ' ARG . 67.2 m-85 -105.62 142.81 34.71 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.324 -0.86 . . . . 0.0 109.437 179.608 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.552 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 68.4 m-85 -109.66 144.5 37.93 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.285 -0.884 . . . . 0.0 109.44 -179.406 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 -128.22 141.81 51.35 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.246 -0.909 . . . . 0.0 109.543 -179.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.461 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.4 OUTLIER -99.95 177.04 1.66 Allowed Pre-proline 0 N--CA 1.489 1.52 0 O-C-N 121.254 -0.904 . . . . 0.0 109.506 179.485 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.461 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 47.1 Cg_exo -55.45 -35.43 92.1 Favored 'Trans proline' 0 C--N 1.306 -1.704 0 C-N-CA 122.77 2.313 . . . . 0.0 112.31 -178.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 68.1 m -80.35 -4.4 53.31 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.206 -0.934 . . . . 0.0 109.482 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 89.42 16.0 57.78 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 179.722 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -66.75 122.15 17.02 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.262 -1.14 . . . . 0.0 109.471 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.403 ' CE ' ' CD2' ' A' ' 36' ' ' PHE . 87.4 tttt -93.99 123.03 37.09 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.267 -0.896 . . . . 0.0 109.472 179.306 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.609 ' N ' ' CD1' ' A' ' 45' ' ' PHE . 1.6 p90 -140.92 148.37 40.32 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.335 -0.853 . . . . 0.0 109.418 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.417 ' HD3' ' CE2' ' A' ' 36' ' ' PHE . 65.7 ttp85 -134.07 65.46 1.57 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.184 -0.947 . . . . 0.0 109.508 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.9 m -150.12 130.28 13.6 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.231 -0.918 . . . . 0.0 109.452 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.719 ' N ' ' HD2' ' A' ' 49' ' ' PRO . 24.1 tttt -62.8 -54.08 50.43 Favored Pre-proline 0 N--CA 1.49 1.53 0 O-C-N 121.279 -0.888 . . . . 0.0 109.489 -179.857 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.719 ' HD2' ' N ' ' A' ' 48' ' ' LYS . 18.9 Cg_endo -57.65 -38.66 92.65 Favored 'Trans proline' 0 C--N 1.306 -1.692 0 C-N-CA 122.792 2.328 . . . . 0.0 112.198 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -65.39 -39.73 92.57 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.28 -0.887 . . . . 0.0 109.5 179.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.779 HD23 ' O ' ' A' ' 51' ' ' LEU . 5.1 tt -69.29 -41.15 77.2 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.26 -0.9 . . . . 0.0 109.536 179.797 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.576 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -62.62 -43.02 99.86 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.185 -0.947 . . . . 0.0 109.472 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.493 HH12 ' HB2' ' A' ' 49' ' ' PRO . 92.6 mtm-85 -59.45 -42.51 92.14 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.306 -0.871 . . . . 0.0 109.479 179.492 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -59.78 -50.23 74.63 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.396 -0.815 . . . . 0.0 109.508 179.127 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.577 HD11 ' CG ' ' A' ' 14' ' ' PRO . 3.6 mm? -85.78 -0.13 54.43 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.186 -0.946 . . . . 0.0 109.491 178.383 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . 0.576 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -61.87 97.6 0.16 Allowed Glycine 0 N--CA 1.492 2.367 0 N-CA-C 109.506 -1.438 . . . . 0.0 109.506 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 132.26 -63.98 0.62 Allowed Glycine 0 N--CA 1.489 2.226 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 76.2 p -69.88 -24.75 63.46 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.182 -1.187 . . . . 0.0 109.574 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.569 ' HB3' HD12 ' A' ' 55' ' ' LEU . 55.1 ttm -159.3 149.5 19.13 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.229 -0.92 . . . . 0.0 109.475 -179.717 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.569 ' C ' HD12 ' A' ' 61' ' ' LEU . 49.8 t0 -95.16 117.04 29.54 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.235 -0.916 . . . . 0.0 109.45 179.63 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.569 HD12 ' C ' ' A' ' 60' ' ' ASP . 10.7 mp -113.44 10.23 18.24 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.336 -0.853 . . . . 0.0 109.433 -179.392 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 50.3 m -52.44 -37.28 56.54 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.234 -0.916 . . . . 0.0 109.463 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 17.9 p -92.62 18.83 8.11 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.188 -0.945 . . . . 0.0 109.485 179.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.563 ' CE1' ' HB3' ' A' ' 12' ' ' ALA . 70.0 t80 -90.99 132.58 35.9 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.19 -0.944 . . . . 0.0 109.387 179.628 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.503 ' O ' ' N ' ' A' ' 69' ' ' GLY . 60.7 t0 -82.63 112.65 19.71 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.205 -0.935 . . . . 0.0 109.563 179.911 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.552 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 73.7 t80 -75.17 -44.3 47.43 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.207 -0.933 . . . . 0.0 109.417 -179.23 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 13.7 tpt180 -58.06 -44.5 87.49 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.263 -0.898 . . . . 0.0 109.423 -179.118 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . 0.452 ' OG1' ' CG ' ' A' ' 65' ' ' ASP . 49.7 p -97.13 -12.94 22.49 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.292 -0.88 . . . . 0.0 109.468 -179.288 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . 0.503 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 61.65 40.86 99.32 Favored Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -130.77 156.24 45.3 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.314 -1.109 . . . . 0.0 109.453 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.483 ' HB2' ' HB2' ' A' ' 12' ' ' ALA . 5.4 ttm -94.98 120.43 35.18 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.267 -0.895 . . . . 0.0 109.492 179.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.448 HD22 ' HA ' ' A' ' 72' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.573 0 O-C-N 121.269 -0.894 . . . . 0.0 109.424 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.419 ' HD2' ' N ' ' A' ' 5' ' ' ARG . 11.7 mpt_? . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.58 96.84 7.63 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.263 -0.898 . . . . 0.0 109.529 -179.6 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.444 ' O ' ' CG ' ' A' ' 8' ' ' TRP . 99.3 mtt180 -71.81 167.59 19.65 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.254 -0.904 . . . . 0.0 109.5 179.604 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.444 ' CG ' ' O ' ' A' ' 7' ' ' ARG . 0.8 OUTLIER -166.21 144.66 5.66 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.17 -0.956 . . . . 0.0 109.514 -179.716 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.465 ' N ' ' OE1' ' A' ' 9' ' ' GLU . 58.7 mp0 -92.56 137.05 32.7 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.25 -0.906 . . . . 0.0 109.454 179.73 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.539 ' SG ' ' O ' ' A' ' 69' ' ' GLY . 0.5 OUTLIER -115.11 101.44 54.49 Favored Pre-proline 0 N--CA 1.49 1.529 0 O-C-N 121.301 -0.874 . . . . 0.0 109.567 -179.831 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -51.3 -37.79 60.83 Favored 'Trans proline' 0 C--N 1.306 -1.683 0 C-N-CA 122.872 2.381 . . . . 0.0 112.208 179.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.94 -24.3 64.25 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.213 -0.929 . . . . 0.0 109.511 179.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 7.2 mp -87.41 157.13 53.43 Favored Pre-proline 0 N--CA 1.49 1.554 0 O-C-N 121.324 -0.86 . . . . 0.0 109.542 179.491 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . 0.461 ' HG2' ' CD1' ' A' ' 17' ' ' TRP . 18.0 Cg_endo -59.8 140.76 94.79 Favored 'Trans proline' 0 C--N 1.305 -1.742 0 C-N-CA 122.802 2.334 . . . . 0.0 112.172 -179.694 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -53.18 121.49 7.61 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.279 -0.888 . . . . 0.0 109.524 -179.175 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 122.6 -27.48 5.98 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 179.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . 0.461 ' CD1' ' HG2' ' A' ' 14' ' ' PRO . 11.5 m95 -83.69 154.45 23.65 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.343 -1.093 . . . . 0.0 109.553 179.728 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -143.68 157.94 44.03 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.325 -0.86 . . . . 0.0 109.455 -179.436 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.57 ' NH1' ' O ' ' A' ' 69' ' ' GLY . 33.8 ptt180 -124.42 163.56 21.53 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.244 -0.91 . . . . 0.0 109.485 179.777 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -141.8 140.92 33.13 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.284 -0.885 . . . . 0.0 109.571 -179.172 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 28.5 tp10 -101.89 122.36 43.86 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.317 -0.865 . . . . 0.0 109.438 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.419 HG13 ' HE ' ' A' ' 5' ' ' ARG . 2.5 t -118.25 98.47 51.41 Favored Pre-proline 0 N--CA 1.49 1.529 0 O-C-N 121.17 -0.956 . . . . 0.0 109.639 -179.778 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -58.58 128.04 26.8 Favored 'Trans proline' 0 C--N 1.305 -1.712 0 C-N-CA 122.851 2.367 . . . . 0.0 112.184 179.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.421 ' NE ' ' HB2' ' A' ' 34' ' ' ASP . 99.5 mtt180 . . . . . 0 N--CA 1.49 1.529 0 O-C-N 121.148 -0.97 . . . . 0.0 109.462 178.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 73.6 m80 . . . . . 0 N--CA 1.491 1.577 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 94.9 mtt-85 -110.59 121.51 45.5 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.26 -0.9 . . . . 0.0 109.518 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.421 ' HB2' ' NE ' ' A' ' 24' ' ' ARG . 58.6 t0 -84.38 136.68 33.78 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.318 -0.864 . . . . 0.0 109.474 179.32 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 25.0 t -111.06 128.16 67.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.267 -0.896 . . . . 0.0 109.502 -179.128 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 52.9 m-85 -117.44 147.15 42.97 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.245 -0.909 . . . . 0.0 109.499 179.098 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 -117.8 148.96 41.58 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.195 -0.941 . . . . 0.0 109.363 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.425 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 12.9 m-85 -133.21 144.59 49.9 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.216 -0.928 . . . . 0.0 109.579 -178.759 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.6 p -103.38 159.44 29.28 Favored Pre-proline 0 N--CA 1.491 1.584 0 O-C-N 121.24 -0.913 . . . . 0.0 109.474 179.051 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -54.01 -16.36 9.01 Favored 'Trans proline' 0 C--N 1.304 -1.779 0 C-N-CA 122.788 2.325 . . . . 0.0 112.271 178.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 4.5 m -86.15 -2.16 58.09 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.242 -0.911 . . . . 0.0 109.526 179.081 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 84.83 5.83 85.94 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 41.6 tttp -75.67 119.61 19.93 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.255 -1.144 . . . . 0.0 109.38 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -93.53 121.98 35.49 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.221 -0.924 . . . . 0.0 109.487 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.456 ' CZ ' ' CZ3' ' A' ' 17' ' ' TRP . 2.7 p90 -141.0 149.69 42.09 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.252 -0.905 . . . . 0.0 109.437 178.865 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.696 ' O ' ' C ' ' A' ' 47' ' ' SER . 70.8 ttp85 -124.58 -72.54 0.67 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.321 -0.862 . . . . 0.0 109.463 179.815 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.696 ' C ' ' O ' ' A' ' 46' ' ' ARG . 0.7 OUTLIER -21.26 130.41 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.321 -0.862 . . . . 0.0 109.503 179.664 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.656 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 4.8 tttm -65.74 -42.79 57.01 Favored Pre-proline 0 N--CA 1.491 1.584 0 O-C-N 121.171 -0.956 . . . . 0.0 109.498 179.866 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.656 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 49.8 Cg_exo -54.77 -49.62 16.12 Favored 'Trans proline' 0 C--N 1.306 -1.704 0 C-N-CA 122.831 2.354 . . . . 0.0 112.253 -179.521 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.422 ' HG2' ' N ' ' A' ' 51' ' ' LEU . 0.6 OUTLIER -68.01 -33.78 75.25 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.282 -0.886 . . . . 0.0 109.546 179.765 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.422 ' N ' ' HG2' ' A' ' 50' ' ' GLN . 6.9 tt -62.55 -43.88 97.73 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.281 -0.887 . . . . 0.0 109.46 179.68 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -69.84 -40.21 75.95 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.238 -0.914 . . . . 0.0 109.503 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 70.8 ttp85 -58.44 -44.15 89.04 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.291 -0.881 . . . . 0.0 109.535 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 42.8 t80 -59.54 -50.68 72.98 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.228 -0.92 . . . . 0.0 109.545 179.51 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.406 HD21 ' CZ2' ' A' ' 17' ' ' TRP . 80.1 mt -58.12 -43.15 87.05 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.158 -0.964 . . . . 0.0 109.47 179.278 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . 0.412 ' O ' ' C ' ' A' ' 57' ' ' GLY . . . 65.35 83.07 0.1 OUTLIER Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 179.086 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . 0.412 ' C ' ' O ' ' A' ' 56' ' ' GLY . . . 44.08 72.95 0.28 Allowed Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.515 -1.434 . . . . 0.0 109.515 179.058 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 6.9 m -119.5 -26.7 5.71 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.256 -1.144 . . . . 0.0 109.509 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.587 ' SD ' HD21 ' A' ' 61' ' ' LEU . 0.2 OUTLIER -169.34 160.0 9.12 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.29 -0.881 . . . . 0.0 109.506 179.94 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 50.5 t0 -80.6 92.36 5.94 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.345 -0.847 . . . . 0.0 109.5 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.587 HD21 ' SD ' ' A' ' 59' ' ' MET . 96.0 mt -100.98 -0.56 36.35 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.279 -0.888 . . . . 0.0 109.402 -179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 5.0 t -54.4 -30.84 53.49 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.268 -0.895 . . . . 0.0 109.522 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 76.0 p -92.27 11.49 25.63 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.225 -0.922 . . . . 0.0 109.437 179.723 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.41 ' CZ ' ' C ' ' A' ' 69' ' ' GLY . 74.3 t80 -86.89 131.78 34.01 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.27 -0.894 . . . . 0.0 109.519 -179.74 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.518 ' O ' ' N ' ' A' ' 69' ' ' GLY . 55.8 t0 -82.94 114.82 21.48 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.266 -0.896 . . . . 0.0 109.478 -179.629 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 24.2 t80 -75.18 -47.42 28.45 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.179 -0.95 . . . . 0.0 109.523 -179.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 7.7 mmt85 -55.22 -42.33 73.23 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.133 -0.98 . . . . 0.0 109.478 -179.002 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . 0.404 ' OG1' ' CG ' ' A' ' 65' ' ' ASP . 33.2 p -98.69 -13.97 20.02 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.223 -0.923 . . . . 0.0 109.53 -179.455 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . 0.57 ' O ' ' NH1' ' A' ' 19' ' ' ARG . . . 61.07 40.85 99.1 Favored Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 179.777 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -134.8 153.77 51.89 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.297 -1.12 . . . . 0.0 109.492 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 12.8 ttm -87.41 126.28 34.78 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.271 -0.893 . . . . 0.0 109.479 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 72' ' ' LEU . 97.0 mt . . . . . 0 N--CA 1.489 1.506 0 O-C-N 121.239 -0.913 . . . . 0.0 109.501 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 61.0 ttp180 . . . . . 0 N--CA 1.49 1.534 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.4 mptt -120.9 113.96 20.87 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.25 -0.906 . . . . 0.0 109.447 179.766 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.448 ' CZ ' ' OE2' ' A' ' 18' ' ' GLU . 14.8 ttp180 -96.36 118.05 32.11 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.285 -0.884 . . . . 0.0 109.468 -179.548 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 5.1 m0 -106.43 156.26 18.72 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.3 -0.875 . . . . 0.0 109.502 179.464 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 84.9 tt0 -72.45 148.73 44.86 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.3 -0.875 . . . . 0.0 109.51 -179.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.592 ' SG ' ' CZ ' ' A' ' 19' ' ' ARG . 74.8 m -106.69 104.83 52.86 Favored Pre-proline 0 N--CA 1.49 1.559 0 O-C-N 121.244 -0.91 . . . . 0.0 109.473 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.405 ' HD2' HH22 ' A' ' 19' ' ' ARG . 55.5 Cg_endo -76.56 -21.19 13.24 Favored 'Trans proline' 0 C--N 1.306 -1.671 0 C-N-CA 122.78 2.32 . . . . 0.0 112.241 -179.565 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -84.24 -34.91 23.76 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.225 -0.922 . . . . 0.0 109.498 179.498 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.618 ' CD1' ' N ' ' A' ' 13' ' ' LEU . 4.6 mp -82.6 156.48 68.13 Favored Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.215 -0.928 . . . . 0.0 109.435 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -51.64 140.26 46.24 Favored 'Trans proline' 0 C--N 1.305 -1.722 0 C-N-CA 122.827 2.352 . . . . 0.0 112.192 179.352 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.602 ' NE2' ' H ' ' A' ' 15' ' ' GLN . 4.0 mp0 -45.85 122.85 4.01 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.27 -0.894 . . . . 0.0 109.448 -179.836 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 123.25 -18.86 7.77 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.59 -1.404 . . . . 0.0 109.59 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . 0.708 ' CZ2' HD21 ' A' ' 55' ' ' LEU . 26.5 m95 -92.65 151.18 20.24 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.176 -1.191 . . . . 0.0 109.499 179.405 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.448 ' OE2' ' CZ ' ' A' ' 7' ' ' ARG . 71.3 mt-10 -148.89 162.51 39.71 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.181 -0.949 . . . . 0.0 109.487 -179.399 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.592 ' CZ ' ' SG ' ' A' ' 10' ' ' CYS . 10.9 ptp85 -140.04 146.11 38.57 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.298 -0.876 . . . . 0.0 109.492 179.58 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -139.13 146.71 40.98 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.203 -0.935 . . . . 0.0 109.471 -178.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -103.1 140.14 37.7 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.311 -0.868 . . . . 0.0 109.47 178.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.0 t -141.6 123.48 9.12 Favored Pre-proline 0 N--CA 1.491 1.598 0 O-C-N 121.227 -0.921 . . . . 0.0 109.584 -179.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -75.4 135.41 18.33 Favored 'Trans proline' 0 C--N 1.304 -1.767 0 C-N-CA 122.863 2.375 . . . . 0.0 112.153 178.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 18.6 ttm180 . . . . . 0 N--CA 1.489 1.519 0 O-C-N 121.176 -0.953 . . . . 0.0 109.527 -179.927 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 73.9 m80 . . . . . 0 N--CA 1.488 1.443 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 17.2 ptp180 -117.7 134.59 54.74 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.214 -0.929 . . . . 0.0 109.486 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -105.2 141.88 35.95 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.281 -0.887 . . . . 0.0 109.45 -179.057 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 43.6 t -109.76 135.71 47.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.236 -0.915 . . . . 0.0 109.414 179.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 55.3 m-85 -121.96 144.18 49.03 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.17 -0.956 . . . . 0.0 109.49 -179.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.582 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 54.6 m-85 -115.68 147.89 40.34 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.284 -0.885 . . . . 0.0 109.475 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 36.4 m-85 -127.25 141.04 51.82 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.297 -0.877 . . . . 0.0 109.456 -179.524 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.458 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.4 OUTLIER -98.86 177.64 1.52 Allowed Pre-proline 0 N--CA 1.49 1.553 0 O-C-N 121.375 -0.828 . . . . 0.0 109.397 179.448 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.458 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 53.0 Cg_exo -54.36 -34.67 81.57 Favored 'Trans proline' 0 C--N 1.305 -1.726 0 C-N-CA 122.861 2.374 . . . . 0.0 112.322 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 46.6 t -85.8 1.16 50.8 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.298 -0.876 . . . . 0.0 109.468 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 85.41 15.86 65.5 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 81.9 tttt -66.52 121.54 15.57 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.189 -1.183 . . . . 0.0 109.514 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 62.4 tttm -92.77 124.85 37.07 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.206 -0.933 . . . . 0.0 109.506 179.612 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.553 ' N ' ' CD1' ' A' ' 45' ' ' PHE . 2.3 p90 -139.88 146.12 38.89 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.264 -0.898 . . . . 0.0 109.455 -179.721 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 14.9 ptm180 -136.64 59.57 1.69 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.233 -0.917 . . . . 0.0 109.493 179.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.7 p -153.35 137.65 16.6 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.324 -0.86 . . . . 0.0 109.476 179.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.607 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 0.9 OUTLIER -66.52 -46.23 58.34 Favored Pre-proline 0 N--CA 1.489 1.499 0 O-C-N 121.314 -0.866 . . . . 0.0 109.503 -179.298 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.607 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 44.3 Cg_exo -55.83 -48.88 17.71 Favored 'Trans proline' 0 C--N 1.305 -1.738 0 C-N-CA 122.855 2.37 . . . . 0.0 112.261 -178.817 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.475 HE21 ' HB2' ' A' ' 45' ' ' PHE . 17.6 tt0 -65.76 -37.42 86.29 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.229 -0.919 . . . . 0.0 109.502 -179.833 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 44.5 tp -65.75 -47.57 74.78 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.286 -0.883 . . . . 0.0 109.553 -179.31 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.648 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -67.01 -45.55 77.23 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.324 -0.86 . . . . 0.0 109.51 -179.58 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 62.6 ttp180 -60.68 -45.54 93.75 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.173 -0.954 . . . . 0.0 109.514 -179.637 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 25.5 t80 -63.08 -52.57 62.2 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.301 -0.874 . . . . 0.0 109.479 -179.066 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.708 HD21 ' CZ2' ' A' ' 17' ' ' TRP . 98.0 mt -88.7 3.98 48.87 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.21 -0.931 . . . . 0.0 109.447 -179.922 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . 0.648 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -61.89 -39.66 97.81 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.49 -1.444 . . . . 0.0 109.49 -179.621 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -83.23 2.35 87.19 Favored Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.51 -1.436 . . . . 0.0 109.51 -179.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 79.3 p -119.13 -23.31 6.86 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.326 -1.103 . . . . 0.0 109.457 -179.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 8.3 ttm -176.49 168.99 2.68 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.29 -0.881 . . . . 0.0 109.459 -179.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.517 ' C ' HD22 ' A' ' 61' ' ' LEU . 93.5 m-20 -96.39 114.57 26.26 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.226 -0.921 . . . . 0.0 109.5 179.382 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.567 ' N ' HD22 ' A' ' 61' ' ' LEU . 3.6 mm? -98.31 4.69 48.68 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.231 -0.918 . . . . 0.0 109.49 -179.404 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 77.5 p -58.03 -38.26 75.9 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.252 -0.905 . . . . 0.0 109.46 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 19.6 p -87.56 6.21 35.5 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.269 -0.894 . . . . 0.0 109.463 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.416 ' CZ ' ' HA2' ' A' ' 69' ' ' GLY . 55.6 t80 -91.88 122.88 34.82 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.22 -0.925 . . . . 0.0 109.448 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.451 ' O ' ' N ' ' A' ' 69' ' ' GLY . 97.5 m-20 -75.35 114.38 13.82 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.25 -0.906 . . . . 0.0 109.493 179.805 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.582 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 81.9 t80 -77.76 -41.03 38.98 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.227 -0.921 . . . . 0.0 109.497 -179.378 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -61.56 -45.12 95.5 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.198 -0.939 . . . . 0.0 109.459 -179.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 46.0 p -95.06 -15.53 23.37 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.229 -0.919 . . . . 0.0 109.499 -179.505 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . 0.451 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 63.92 44.64 95.75 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.57 -1.412 . . . . 0.0 109.57 -179.683 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 64.8 mttp -142.22 158.27 43.92 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.224 -1.163 . . . . 0.0 109.444 -179.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 1.2 mmt -79.69 136.81 36.88 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.232 -0.917 . . . . 0.0 109.435 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.43 HD12 ' HA ' ' A' ' 72' ' ' LEU . 48.9 tp . . . . . 0 N--CA 1.489 1.496 0 O-C-N 121.177 -0.952 . . . . 0.0 109.499 -179.712 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 95.3 mtt-85 . . . . . 0 N--CA 1.49 1.564 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 73.6 mttt -72.98 153.7 40.83 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.288 -0.883 . . . . 0.0 109.445 179.844 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.584 ' O ' ' CD1' ' A' ' 8' ' ' TRP . 51.4 ptt85 -149.37 140.88 23.36 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.181 -0.949 . . . . 0.0 109.506 -179.309 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.584 ' CD1' ' O ' ' A' ' 7' ' ' ARG . 7.0 m0 -147.95 129.16 14.67 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.264 -0.897 . . . . 0.0 109.513 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -99.63 127.36 45.73 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.306 -0.871 . . . . 0.0 109.458 179.523 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.475 ' HB3' ' HE ' ' A' ' 19' ' ' ARG . 4.7 t -103.47 134.79 19.56 Favored Pre-proline 0 N--CA 1.491 1.619 0 O-C-N 121.277 -0.89 . . . . 0.0 109.414 -179.629 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -69.54 -14.07 36.22 Favored 'Trans proline' 0 C--N 1.306 -1.696 0 C-N-CA 122.861 2.374 . . . . 0.0 112.194 -179.677 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.458 ' C ' HD22 ' A' ' 13' ' ' LEU . . . -69.39 -34.68 74.88 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.174 -0.954 . . . . 0.0 109.462 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.661 HD22 ' N ' ' A' ' 13' ' ' LEU . 2.6 mm? -91.02 150.47 41.84 Favored Pre-proline 0 N--CA 1.489 1.523 0 O-C-N 121.18 -0.95 . . . . 0.0 109.437 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . 0.402 ' HG2' ' CD1' ' A' ' 17' ' ' TRP . 28.3 Cg_endo -63.94 156.98 55.2 Favored 'Trans proline' 0 C--N 1.305 -1.725 0 C-N-CA 122.748 2.298 . . . . 0.0 112.219 -179.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 55.7 tt0 -53.29 128.02 26.72 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.227 -0.921 . . . . 0.0 109.451 -179.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 124.82 -23.64 6.21 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.589 -1.404 . . . . 0.0 109.589 179.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . 0.448 ' CH2' ' CD2' ' A' ' 55' ' ' LEU . 49.9 m95 -87.64 143.66 27.07 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.294 -1.121 . . . . 0.0 109.406 179.708 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -143.55 156.7 44.68 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.27 -0.894 . . . . 0.0 109.515 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.532 HH21 HD23 ' A' ' 13' ' ' LEU . 53.0 mtt-85 -129.38 129.44 44.75 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.292 -0.88 . . . . 0.0 109.447 179.038 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -134.04 140.43 46.66 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.273 -0.892 . . . . 0.0 109.515 -179.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -104.57 149.05 25.84 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.246 -0.909 . . . . 0.0 109.428 178.595 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 4.7 t -145.84 124.76 6.61 Favored Pre-proline 0 N--CA 1.491 1.625 0 O-C-N 121.209 -0.932 . . . . 0.0 109.598 -179.43 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -75.32 136.47 19.8 Favored 'Trans proline' 0 C--N 1.304 -1.784 0 C-N-CA 122.849 2.366 . . . . 0.0 112.133 179.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 6.4 tpt180 . . . . . 0 N--CA 1.491 1.575 0 O-C-N 121.248 -0.907 . . . . 0.0 109.496 179.767 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 80.4 m80 . . . . . 0 N--CA 1.492 1.627 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 88.0 mtm-85 -118.94 136.68 53.95 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.175 -0.953 . . . . 0.0 109.492 179.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 93.4 m-20 -116.61 141.31 48.36 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.278 -0.889 . . . . 0.0 109.444 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.6 t -105.19 132.79 51.16 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.26 -0.9 . . . . 0.0 109.435 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -120.76 143.3 48.88 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.223 -0.923 . . . . 0.0 109.51 179.621 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 50.6 m-85 -118.63 146.64 44.5 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.209 -0.932 . . . . 0.0 109.437 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -127.71 138.36 52.77 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.241 -0.912 . . . . 0.0 109.552 -179.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.498 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.4 OUTLIER -99.85 179.32 1.06 Allowed Pre-proline 0 N--CA 1.49 1.545 0 O-C-N 121.194 -0.941 . . . . 0.0 109.504 179.147 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.498 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 40.2 Cg_exo -56.43 -32.59 89.54 Favored 'Trans proline' 0 C--N 1.305 -1.76 0 C-N-CA 122.81 2.34 . . . . 0.0 112.289 -179.628 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 7.4 m -87.08 5.13 39.16 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.369 -0.832 . . . . 0.0 109.594 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 81.43 10.07 85.03 Favored Glycine 0 N--CA 1.49 2.234 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 64.9 tttp -62.89 119.43 9.37 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.238 -1.154 . . . . 0.0 109.492 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.97 123.33 39.52 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.217 -0.927 . . . . 0.0 109.429 179.045 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 41.8 p90 -141.02 147.05 38.05 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.239 -0.913 . . . . 0.0 109.493 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 44.7 ptt85 -130.6 56.05 1.79 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.253 -0.904 . . . . 0.0 109.51 179.499 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -159.33 146.77 17.19 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.193 -0.942 . . . . 0.0 109.522 -179.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.655 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 0.5 OUTLIER -68.87 -42.87 25.38 Favored Pre-proline 0 N--CA 1.49 1.562 0 O-C-N 121.207 -0.933 . . . . 0.0 109.504 -179.581 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.655 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 51.0 Cg_exo -55.01 -44.63 47.81 Favored 'Trans proline' 0 C--N 1.306 -1.686 0 C-N-CA 122.761 2.307 . . . . 0.0 112.231 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 18.2 mm100 -71.32 -37.0 71.79 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.229 -0.919 . . . . 0.0 109.445 179.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.722 HD23 ' O ' ' A' ' 51' ' ' LEU . 3.8 tt -63.44 -47.36 82.21 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.263 -0.898 . . . . 0.0 109.502 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -66.15 -41.91 89.74 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.182 -0.949 . . . . 0.0 109.497 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 77.7 ttt-85 -56.45 -45.39 80.86 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.223 -0.923 . . . . 0.0 109.511 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -66.24 -50.0 65.27 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.325 -0.86 . . . . 0.0 109.455 179.284 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.448 ' CD2' ' CH2' ' A' ' 17' ' ' TRP . 4.2 mm? -70.9 -3.32 18.62 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.199 -0.938 . . . . 0.0 109.415 179.704 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . 0.711 ' O ' ' N ' ' A' ' 58' ' ' SER . . . -50.87 161.68 1.28 Allowed Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.534 -1.426 . . . . 0.0 109.534 179.771 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 59.38 -61.04 0.01 OUTLIER Glycine 0 N--CA 1.489 2.226 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 -179.529 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.711 ' N ' ' O ' ' A' ' 56' ' ' GLY . 80.7 p -60.88 -28.96 69.27 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.273 -1.133 . . . . 0.0 109.463 -178.761 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.429 ' CB ' ' O ' ' A' ' 58' ' ' SER . 2.8 mtp 169.45 126.88 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.219 -0.926 . . . . 0.0 109.452 -179.479 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.794 ' O ' HD12 ' A' ' 61' ' ' LEU . 62.0 t0 -70.62 151.74 44.66 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.313 -0.867 . . . . 0.0 109.424 179.312 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.794 HD12 ' O ' ' A' ' 60' ' ' ASP . 3.7 mp -133.19 24.87 4.2 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.273 -0.892 . . . . 0.0 109.494 -179.04 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 58.0 m -52.61 -32.68 42.85 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.148 -0.97 . . . . 0.0 109.484 -179.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . 0.509 ' O ' ' SD ' ' A' ' 71' ' ' MET . 19.8 p -94.71 35.14 1.26 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.227 -0.92 . . . . 0.0 109.481 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 93.1 t80 -99.05 129.06 45.3 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.259 -0.901 . . . . 0.0 109.455 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 91.7 m-20 -81.9 114.29 20.41 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.253 -0.904 . . . . 0.0 109.375 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -76.45 -41.13 48.47 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.305 -0.872 . . . . 0.0 109.476 -179.549 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 23.1 mmm180 -63.24 -36.34 83.35 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.312 -0.868 . . . . 0.0 109.444 -178.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 19.5 p -95.53 -16.04 22.45 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.299 -0.875 . . . . 0.0 109.476 -179.414 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 64.64 36.48 93.19 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.571 -1.412 . . . . 0.0 109.571 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.8 mtmp? -145.87 162.52 37.54 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.355 -1.085 . . . . 0.0 109.439 -179.573 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.509 ' SD ' ' O ' ' A' ' 63' ' ' THR . 9.6 tpp -80.84 128.33 33.54 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.235 -0.916 . . . . 0.0 109.534 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.537 ' C ' HD23 ' A' ' 72' ' ' LEU . 3.5 tt . . . . . 0 N--CA 1.491 1.605 0 O-C-N 121.336 -0.852 . . . . 0.0 109.472 -179.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 84.5 mtp180 . . . . . 0 N--CA 1.491 1.594 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.405 ' O ' ' HA ' ' A' ' 20' ' ' GLU . 26.3 mmtp -109.49 101.0 9.99 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.234 -0.916 . . . . 0.0 109.495 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 41.1 ttm180 -98.35 118.69 35.56 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.225 -0.922 . . . . 0.0 109.392 -179.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.555 ' CD1' ' N ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -132.53 152.03 51.71 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.239 -0.913 . . . . 0.0 109.503 179.284 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 79.3 tt0 -90.91 141.78 28.46 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.301 -0.874 . . . . 0.0 109.473 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -108.25 159.49 30.48 Favored Pre-proline 0 N--CA 1.49 1.533 0 O-C-N 121.336 -0.853 . . . . 0.0 109.454 179.841 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -65.05 -20.62 63.72 Favored 'Trans proline' 0 C--N 1.304 -1.764 0 C-N-CA 122.855 2.37 . . . . 0.0 112.237 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.566 ' HB3' ' CE1' ' A' ' 64' ' ' PHE . . . -93.29 -4.92 50.88 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.165 -0.959 . . . . 0.0 109.473 179.723 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.507 HD23 ' CA ' ' A' ' 18' ' ' GLU . 8.7 mp -98.95 113.41 64.54 Favored Pre-proline 0 N--CA 1.491 1.601 0 O-C-N 121.184 -0.948 . . . . 0.0 109.46 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . 0.731 ' HG2' HD11 ' A' ' 55' ' ' LEU . 49.1 Cg_exo -50.75 155.51 5.5 Favored 'Trans proline' 0 C--N 1.306 -1.707 0 C-N-CA 122.756 2.304 . . . . 0.0 112.261 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -49.93 106.8 0.13 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.305 -0.872 . . . . 0.0 109.523 179.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 125.89 -25.23 5.59 Favored Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.621 -1.392 . . . . 0.0 109.621 179.171 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . 0.436 ' CE2' ' HD3' ' A' ' 40' ' ' PRO . 47.6 m95 -92.86 139.7 30.27 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.302 -1.116 . . . . 0.0 109.467 178.385 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.507 ' CA ' HD23 ' A' ' 13' ' ' LEU . 96.3 mt-10 -151.73 166.19 32.07 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.211 -0.93 . . . . 0.0 109.501 -178.665 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.511 ' NH1' ' OH ' ' A' ' 37' ' ' TYR . 12.1 ptm180 -140.92 145.86 36.64 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.27 -0.894 . . . . 0.0 109.384 178.887 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.405 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 12.2 pt-20 -132.92 145.98 51.39 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.239 -0.913 . . . . 0.0 109.462 -179.117 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 79.7 tt0 -100.01 136.67 39.55 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.271 -0.893 . . . . 0.0 109.452 178.684 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.5 t -135.4 133.71 20.67 Favored Pre-proline 0 N--CA 1.49 1.566 0 O-C-N 121.158 -0.964 . . . . 0.0 109.584 -178.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -50.11 150.86 9.75 Favored 'Trans proline' 0 C--N 1.304 -1.779 0 C-N-CA 122.821 2.347 . . . . 0.0 112.099 178.296 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.639 0 O-C-N 121.201 -0.937 . . . . 0.0 109.44 -179.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 56.8 m80 . . . . . 0 N--CA 1.491 1.592 0 CA-C-O 121.341 0.591 . . . . 0.0 109.493 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -116.8 134.77 54.38 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.14 -0.975 . . . . 0.0 109.492 179.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.597 ' OD2' ' CE2' ' A' ' 36' ' ' PHE . 9.2 t70 -103.12 140.73 36.94 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.202 -0.936 . . . . 0.0 109.481 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.592 ' O ' ' CD ' ' A' ' 46' ' ' ARG . 97.6 t -119.67 132.12 70.3 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.251 -0.905 . . . . 0.0 109.481 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.597 ' CE2' ' OD2' ' A' ' 34' ' ' ASP . 94.5 m-85 -116.2 150.89 36.76 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.221 -0.925 . . . . 0.0 109.542 -179.674 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.596 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 23.2 m-85 -112.69 147.15 37.39 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.257 -0.902 . . . . 0.0 109.463 179.737 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -126.39 139.44 53.27 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.214 -0.929 . . . . 0.0 109.552 -179.502 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -102.23 174.57 2.78 Favored Pre-proline 0 N--CA 1.489 1.51 0 O-C-N 121.251 -0.906 . . . . 0.0 109.419 179.33 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.436 ' HD3' ' CE2' ' A' ' 17' ' ' TRP . 52.8 Cg_exo -52.79 -35.95 71.59 Favored 'Trans proline' 0 C--N 1.306 -1.699 0 C-N-CA 122.85 2.367 . . . . 0.0 112.225 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 4.2 m -82.48 -1.01 49.02 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.342 -0.848 . . . . 0.0 109.476 -179.639 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 87.15 11.93 68.82 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -70.04 116.14 10.06 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.259 -1.142 . . . . 0.0 109.494 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 20.0 pttp -94.92 132.59 39.58 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.13 -0.981 . . . . 0.0 109.5 178.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.443 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 8.5 p90 -141.68 151.8 43.32 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.324 -0.86 . . . . 0.0 109.49 -179.776 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.592 ' CD ' ' O ' ' A' ' 35' ' ' VAL . 24.1 tpt85 -125.26 63.39 1.17 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.175 -0.953 . . . . 0.0 109.494 179.29 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.0 t -150.84 125.66 9.74 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.24 -0.913 . . . . 0.0 109.42 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.716 ' N ' ' HD2' ' A' ' 49' ' ' PRO . 20.1 tttt -65.21 -53.47 40.04 Favored Pre-proline 0 N--CA 1.489 1.48 0 O-C-N 121.233 -0.917 . . . . 0.0 109.506 -179.598 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.716 ' HD2' ' N ' ' A' ' 48' ' ' LYS . 14.5 Cg_endo -56.56 -38.69 94.95 Favored 'Trans proline' 0 C--N 1.304 -1.765 0 C-N-CA 122.877 2.385 . . . . 0.0 112.148 179.19 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -65.5 -35.22 80.23 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.344 -0.848 . . . . 0.0 109.432 179.152 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.807 HD23 ' O ' ' A' ' 51' ' ' LEU . 4.4 tt -68.54 -42.54 78.28 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.277 -0.89 . . . . 0.0 109.491 179.647 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.591 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -62.55 -41.28 98.8 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.268 -0.895 . . . . 0.0 109.463 -179.813 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 71.7 ttp85 -59.5 -48.66 80.79 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.175 -0.953 . . . . 0.0 109.457 179.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 6.2 t80 -63.79 -49.08 74.33 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.268 -0.895 . . . . 0.0 109.524 179.431 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.731 HD11 ' HG2' ' A' ' 14' ' ' PRO . 3.3 mm? -81.34 -0.72 42.42 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.161 -0.962 . . . . 0.0 109.451 179.672 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . 0.591 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -62.07 -35.15 91.05 Favored Glycine 0 N--CA 1.489 2.218 0 N-CA-C 109.604 -1.399 . . . . 0.0 109.604 -179.584 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -88.64 -3.12 78.02 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.459 -1.456 . . . . 0.0 109.459 -179.32 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -112.34 -30.7 7.08 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.308 -1.113 . . . . 0.0 109.494 -179.574 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.437 ' O ' ' O ' ' A' ' 55' ' ' LEU . 31.2 ttp -174.58 167.25 3.86 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.286 -0.884 . . . . 0.0 109.471 -179.771 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.544 ' C ' HD12 ' A' ' 61' ' ' LEU . 93.7 m-20 -92.52 113.36 25.61 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.196 -0.94 . . . . 0.0 109.518 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.544 HD12 ' C ' ' A' ' 60' ' ' ASP . 11.1 mp -111.61 9.54 21.11 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.246 -0.909 . . . . 0.0 109.505 -179.803 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 88.5 p -55.78 -34.8 65.59 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.286 -0.884 . . . . 0.0 109.541 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 10.4 p -91.83 24.86 2.98 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.281 -0.887 . . . . 0.0 109.445 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.566 ' CE1' ' HB3' ' A' ' 12' ' ' ALA . 79.9 t80 -91.41 126.18 36.41 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.103 -0.998 . . . . 0.0 109.438 -179.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.552 ' O ' ' N ' ' A' ' 69' ' ' GLY . 96.5 m-20 -75.84 111.77 11.54 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.211 -0.93 . . . . 0.0 109.513 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.596 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 66.1 t80 -74.29 -45.01 50.36 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.236 -0.915 . . . . 0.0 109.49 -179.385 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 24.6 mmm180 -63.88 -37.9 89.11 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.2 -0.938 . . . . 0.0 109.471 -178.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . 0.402 ' OG1' ' CB ' ' A' ' 65' ' ' ASP . 5.6 p -98.9 -15.26 19.24 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.297 -0.877 . . . . 0.0 109.538 -179.376 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . 0.552 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 62.3 39.11 97.3 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.634 -1.386 . . . . 0.0 109.634 -179.842 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.456 ' H ' ' HB2' ' A' ' 65' ' ' ASP . 71.7 mmtt -133.42 151.59 51.82 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.216 -1.167 . . . . 0.0 109.413 -179.407 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 6.6 ttm -96.01 124.44 40.02 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.201 -0.937 . . . . 0.0 109.381 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 58.0 tp . . . . . 0 N--CA 1.491 1.614 0 O-C-N 121.274 -0.891 . . . . 0.0 109.428 -179.709 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 89.7 mtm180 . . . . . 0 N--CA 1.49 1.567 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.434 ' HD3' ' H ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -72.06 154.86 40.87 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.326 -0.859 . . . . 0.0 109.49 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 62.7 ttp180 -153.3 144.62 23.14 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.229 -0.92 . . . . 0.0 109.388 -179.495 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.627 ' N ' ' CD1' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -166.1 139.48 4.18 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.15 -0.969 . . . . 0.0 109.536 -179.331 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -105.8 117.68 34.65 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.179 -0.951 . . . . 0.0 109.472 178.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.654 ' N ' HH12 ' A' ' 19' ' ' ARG . 10.1 p -92.37 137.45 24.64 Favored Pre-proline 0 N--CA 1.491 1.608 0 O-C-N 121.319 -0.863 . . . . 0.0 109.416 -178.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -69.89 -16.69 37.09 Favored 'Trans proline' 0 C--N 1.304 -1.794 0 C-N-CA 122.783 2.322 . . . . 0.0 112.262 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.492 ' C ' HD22 ' A' ' 13' ' ' LEU . . . -60.22 -31.76 70.47 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.297 -0.877 . . . . 0.0 109.484 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.626 HD22 ' N ' ' A' ' 13' ' ' LEU . 3.7 mm? -95.39 154.44 39.37 Favored Pre-proline 0 N--CA 1.491 1.604 0 O-C-N 121.346 -0.846 . . . . 0.0 109.477 179.825 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -55.42 144.13 74.19 Favored 'Trans proline' 0 C--N 1.306 -1.704 0 C-N-CA 122.798 2.332 . . . . 0.0 112.165 179.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -49.18 129.15 17.72 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.268 -0.895 . . . . 0.0 109.485 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 118.04 -19.89 10.86 Favored Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.594 -1.403 . . . . 0.0 109.594 -179.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . 0.406 ' CZ2' HD11 ' A' ' 55' ' ' LEU . 20.7 m95 -85.09 144.09 28.45 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.232 -1.158 . . . . 0.0 109.45 -179.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -144.63 157.06 44.37 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.253 -0.904 . . . . 0.0 109.477 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.654 HH12 ' N ' ' A' ' 10' ' ' CYS . 32.8 ptt-85 -147.25 152.54 38.48 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.179 -0.951 . . . . 0.0 109.381 179.502 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.401 ' O ' ' CD ' ' A' ' 20' ' ' GLU . 0.0 OUTLIER -150.61 151.0 31.89 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.28 -0.888 . . . . 0.0 109.526 -179.499 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.425 ' OE1' ' CE ' ' A' ' 6' ' ' LYS . 86.4 tt0 -96.57 146.06 25.16 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.268 -0.895 . . . . 0.0 109.326 179.184 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.8 t -144.43 122.79 6.82 Favored Pre-proline 0 N--CA 1.49 1.554 0 O-C-N 121.245 -0.909 . . . . 0.0 109.523 -178.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -75.76 136.51 18.99 Favored 'Trans proline' 0 C--N 1.306 -1.693 0 C-N-CA 122.828 2.352 . . . . 0.0 112.214 179.451 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 95.1 mtt-85 . . . . . 0 N--CA 1.488 1.469 0 O-C-N 121.18 -0.95 . . . . 0.0 109.534 -179.676 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 37.7 m80 . . . . . 0 N--CA 1.489 1.52 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.39 139.49 52.73 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.234 -0.916 . . . . 0.0 109.385 -179.837 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.564 ' OD1' ' N ' ' A' ' 35' ' ' VAL . 67.3 t0 -119.37 142.01 48.54 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.269 -0.894 . . . . 0.0 109.455 -179.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.564 ' N ' ' OD1' ' A' ' 34' ' ' ASP . 62.7 t -110.58 140.82 27.99 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.246 -0.909 . . . . 0.0 109.397 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 65.0 m-85 -122.52 149.98 43.19 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.245 -0.91 . . . . 0.0 109.498 -179.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.562 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 22.3 m-85 -116.58 145.22 43.53 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.289 -0.882 . . . . 0.0 109.408 -179.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -120.5 134.87 55.22 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.209 -0.932 . . . . 0.0 109.445 -179.369 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.503 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -97.6 -179.56 0.9 Allowed Pre-proline 0 N--CA 1.491 1.586 0 O-C-N 121.301 -0.875 . . . . 0.0 109.358 179.221 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.503 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 39.2 Cg_exo -56.86 -28.97 79.69 Favored 'Trans proline' 0 C--N 1.306 -1.671 0 C-N-CA 122.836 2.357 . . . . 0.0 112.151 -179.633 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 94.1 p -91.44 2.48 56.38 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.261 -0.899 . . . . 0.0 109.518 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 83.45 14.78 72.95 Favored Glycine 0 N--CA 1.49 2.243 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 179.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -70.91 123.98 23.28 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.293 -1.122 . . . . 0.0 109.404 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.675 ' NZ ' HH22 ' A' ' 46' ' ' ARG . 18.6 pttp -95.32 129.6 42.4 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.216 -0.927 . . . . 0.0 109.48 179.202 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.659 ' N ' ' CD1' ' A' ' 45' ' ' PHE . 0.7 OUTLIER -140.52 147.85 40.16 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.316 -0.865 . . . . 0.0 109.431 -179.837 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.675 HH22 ' NZ ' ' A' ' 44' ' ' LYS . 6.2 ptp85 -134.06 57.43 1.81 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.288 -0.882 . . . . 0.0 109.466 179.664 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -150.73 132.48 14.97 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.217 -0.927 . . . . 0.0 109.524 -179.78 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.722 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 2.7 tmtm? -71.25 -39.37 7.9 Favored Pre-proline 0 N--CA 1.491 1.593 0 O-C-N 121.319 -0.863 . . . . 0.0 109.488 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.722 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 33.0 Cg_exo -57.6 -55.17 2.61 Favored 'Trans proline' 0 C--N 1.306 -1.699 0 C-N-CA 122.894 2.396 . . . . 0.0 112.181 -179.556 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 26.7 tt0 -69.34 -31.83 70.53 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.274 -0.891 . . . . 0.0 109.474 179.437 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.754 ' C ' HD23 ' A' ' 51' ' ' LEU . 6.6 tt -67.78 -51.79 44.78 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.271 -0.893 . . . . 0.0 109.525 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.678 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -65.11 -42.74 93.7 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.163 -0.96 . . . . 0.0 109.511 179.885 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 80.3 mmt-85 -62.48 -37.89 87.71 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.269 -0.894 . . . . 0.0 109.521 -179.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 33.2 t80 -59.75 -51.66 68.8 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.313 -0.867 . . . . 0.0 109.445 -179.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.427 ' C ' ' N ' ' A' ' 57' ' ' GLY . 79.0 mt -100.3 5.63 44.54 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.24 -0.913 . . . . 0.0 109.517 179.683 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . 0.678 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -52.72 -10.94 1.11 Allowed Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 -179.202 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . 0.427 ' N ' ' C ' ' A' ' 55' ' ' LEU . . . -106.22 -50.12 0.89 Allowed Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.556 -1.417 . . . . 0.0 109.556 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 95.1 p -63.64 -24.25 67.71 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.288 -1.125 . . . . 0.0 109.531 -179.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 2.1 mmm -169.77 163.42 9.83 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.23 -0.919 . . . . 0.0 109.405 -179.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 49.7 t0 -95.37 114.89 26.71 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.222 -0.924 . . . . 0.0 109.465 179.636 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 95.2 mt -110.61 7.05 22.25 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.227 -0.921 . . . . 0.0 109.467 -179.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 33.4 t -51.93 -32.05 31.38 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.2 -0.938 . . . . 0.0 109.437 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 24.2 p -91.99 14.31 16.15 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.238 -0.914 . . . . 0.0 109.452 -179.499 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.525 ' O ' ' NZ ' ' A' ' 48' ' ' LYS . 84.0 t80 -89.7 123.56 33.83 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.248 -0.908 . . . . 0.0 109.44 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 82.4 m-20 -78.59 124.19 27.9 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.325 -0.86 . . . . 0.0 109.448 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.562 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 77.5 t80 -77.45 -43.18 33.28 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.293 -0.879 . . . . 0.0 109.486 179.445 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.22 -45.39 94.77 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.286 -0.884 . . . . 0.0 109.459 -178.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 76.0 p -92.49 -17.85 23.96 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.274 -0.891 . . . . 0.0 109.5 -179.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 62.85 28.59 72.07 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.504 -1.438 . . . . 0.0 109.504 -179.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 64.4 mttp -125.25 153.49 43.11 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.324 -1.103 . . . . 0.0 109.44 -179.436 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.419 ' HB2' ' HB2' ' A' ' 12' ' ' ALA . 24.7 ttm -90.65 126.43 35.97 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.272 -0.893 . . . . 0.0 109.514 -179.745 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.444 ' C ' HD23 ' A' ' 72' ' ' LEU . 1.6 tt . . . . . 0 N--CA 1.489 1.517 0 O-C-N 121.171 -0.956 . . . . 0.0 109.527 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.449 ' NE ' ' OE2' ' A' ' 20' ' ' GLU . 79.3 mtp180 . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 121.352 0.596 . . . . 0.0 109.421 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.457 ' HB3' ' CH2' ' A' ' 8' ' ' TRP . 59.8 mttt -82.9 168.83 16.69 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.183 -0.948 . . . . 0.0 109.472 -179.303 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.426 ' HG2' ' O ' ' A' ' 6' ' ' LYS . 22.7 mmt180 -146.57 138.01 24.45 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.154 -0.967 . . . . 0.0 109.455 -178.179 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.468 ' HE1' ' HB2' ' A' ' 21' ' ' GLU . 12.4 m95 -123.61 118.16 26.68 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.228 -0.92 . . . . 0.0 109.489 179.088 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 -78.41 148.83 33.47 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.22 -0.925 . . . . 0.0 109.518 178.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.536 ' SG ' ' NE ' ' A' ' 19' ' ' ARG . 20.8 p -135.13 101.5 11.29 Favored Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.155 -0.966 . . . . 0.0 109.494 -179.278 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -73.54 -11.44 24.36 Favored 'Trans proline' 0 C--N 1.305 -1.761 0 C-N-CA 122.836 2.358 . . . . 0.0 112.224 179.227 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.513 ' C ' HD22 ' A' ' 13' ' ' LEU . . . -80.21 -21.14 43.23 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.221 -0.924 . . . . 0.0 109.409 178.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.566 HD22 ' N ' ' A' ' 13' ' ' LEU . 3.3 mm? -98.94 156.78 35.13 Favored Pre-proline 0 N--CA 1.489 1.499 0 O-C-N 121.198 -0.939 . . . . 0.0 109.43 179.544 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -52.79 147.51 31.68 Favored 'Trans proline' 0 C--N 1.305 -1.736 0 C-N-CA 122.838 2.359 . . . . 0.0 112.263 178.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 27.3 mm100 -56.64 125.47 22.39 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.232 -0.917 . . . . 0.0 109.507 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 124.54 -18.9 7.18 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.57 -1.412 . . . . 0.0 109.57 179.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . 0.406 ' HB3' HH21 ' A' ' 19' ' ' ARG . 47.9 m95 -91.21 137.35 32.43 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.237 -1.154 . . . . 0.0 109.441 179.319 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -146.58 162.35 38.57 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.236 -0.915 . . . . 0.0 109.485 -179.151 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.536 ' NE ' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -123.04 160.24 26.73 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.274 -0.892 . . . . 0.0 109.473 178.812 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.449 ' OE2' ' NE ' ' A' ' 5' ' ' ARG . 75.6 tt0 -145.11 134.82 23.45 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.29 -0.881 . . . . 0.0 109.464 -179.082 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.533 ' CD ' HG22 ' A' ' 35' ' ' VAL . 4.0 tp10 -103.95 129.97 51.54 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.21 -0.931 . . . . 0.0 109.35 178.191 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.0 t -134.12 99.21 13.68 Favored Pre-proline 0 N--CA 1.489 1.476 0 O-C-N 121.271 -0.893 . . . . 0.0 109.593 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -58.03 135.19 67.08 Favored 'Trans proline' 0 C--N 1.304 -1.796 0 C-N-CA 122.858 2.372 . . . . 0.0 112.122 178.105 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.427 HH11 ' HD2' ' A' ' 24' ' ' ARG . 20.8 ttm105 . . . . . 0 N--CA 1.489 1.505 0 O-C-N 121.231 -0.918 . . . . 0.0 109.464 179.619 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 71.0 m80 . . . . . 0 N--CA 1.489 1.522 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 37.2 ptt-85 -117.26 138.86 51.45 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.343 -0.848 . . . . 0.0 109.481 179.759 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -100.68 138.45 37.72 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.243 -0.911 . . . . 0.0 109.452 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.533 HG22 ' CD ' ' A' ' 21' ' ' GLU . 37.6 t -110.04 134.62 51.6 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.304 -0.872 . . . . 0.0 109.437 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -119.55 145.06 46.7 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.289 -0.882 . . . . 0.0 109.478 179.586 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.689 ' CE1' ' CZ ' ' A' ' 66' ' ' PHE . 7.7 m-85 -114.84 145.27 42.34 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.267 -0.895 . . . . 0.0 109.4 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -123.68 135.52 53.94 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.34 -0.85 . . . . 0.0 109.608 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.457 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -98.21 177.96 1.46 Allowed Pre-proline 0 N--CA 1.49 1.533 0 O-C-N 121.28 -0.888 . . . . 0.0 109.467 179.325 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.457 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 50.0 Cg_exo -55.08 -32.95 81.83 Favored 'Trans proline' 0 C--N 1.305 -1.731 0 C-N-CA 122.82 2.347 . . . . 0.0 112.339 179.862 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 41.1 t -87.52 4.35 43.87 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.341 -0.849 . . . . 0.0 109.494 -179.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 82.09 16.15 72.86 Favored Glycine 0 N--CA 1.489 2.175 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 -179.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -70.25 119.62 14.71 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.29 -1.123 . . . . 0.0 109.509 179.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.443 ' O ' ' HG3' ' A' ' 44' ' ' LYS . 24.3 pttm -94.8 125.03 39.19 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.235 -0.916 . . . . 0.0 109.494 178.873 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 31.8 p90 -141.48 149.04 40.4 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.214 -0.929 . . . . 0.0 109.557 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 26.5 ptt-85 -133.91 60.78 1.69 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.178 -0.951 . . . . 0.0 109.439 179.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.2 m -155.62 138.83 15.63 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.243 -0.911 . . . . 0.0 109.469 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.606 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 2.3 tttm -65.9 -45.8 64.65 Favored Pre-proline 0 N--CA 1.49 1.536 0 O-C-N 121.245 -0.909 . . . . 0.0 109.41 -179.719 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.606 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 49.0 Cg_exo -54.97 -44.4 50.13 Favored 'Trans proline' 0 C--N 1.306 -1.679 0 C-N-CA 122.84 2.36 . . . . 0.0 112.228 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -67.78 -38.15 83.0 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.236 -0.915 . . . . 0.0 109.444 179.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 55.3 tp -65.87 -45.8 80.77 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.31 -0.869 . . . . 0.0 109.397 -179.329 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.707 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -69.02 -44.56 72.48 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.302 -0.874 . . . . 0.0 109.529 -179.648 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 7.9 tpt180 -60.22 -43.3 96.13 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.267 -0.896 . . . . 0.0 109.456 -179.474 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 25.9 t80 -62.64 -52.86 61.68 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.181 -0.95 . . . . 0.0 109.451 -179.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.406 HD23 ' HA ' ' A' ' 55' ' ' LEU . 97.6 mt -90.9 2.53 56.12 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.271 -0.893 . . . . 0.0 109.464 179.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . 0.707 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -45.06 -78.13 0.08 OUTLIER Glycine 0 N--CA 1.491 2.359 0 N-CA-C 109.471 -1.452 . . . . 0.0 109.471 -179.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.32 7.47 0.22 Allowed Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 -179.564 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.563 ' H ' ' C ' ' A' ' 56' ' ' GLY . 3.0 m -104.19 -27.03 12.29 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.228 -1.16 . . . . 0.0 109.533 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.671 ' SD ' HD11 ' A' ' 61' ' ' LEU . 1.7 ptp 178.1 171.25 0.7 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.253 -0.905 . . . . 0.0 109.48 -179.463 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 59.6 t0 -93.56 111.44 23.11 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.194 -0.942 . . . . 0.0 109.397 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.671 HD11 ' SD ' ' A' ' 59' ' ' MET . 10.7 mp -99.73 5.1 45.71 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.239 -0.913 . . . . 0.0 109.428 -179.921 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 23.4 m -46.16 -38.78 8.68 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.279 -0.888 . . . . 0.0 109.462 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 55.8 p -95.35 49.65 1.21 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.301 -0.874 . . . . 0.0 109.4 179.315 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 65.9 t80 -116.61 132.16 56.76 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.302 -0.874 . . . . 0.0 109.477 -179.576 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 91.8 m-20 -93.42 107.75 19.53 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.188 -0.945 . . . . 0.0 109.544 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.689 ' CZ ' ' CE1' ' A' ' 37' ' ' TYR . 53.2 t80 -75.43 -40.36 57.78 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.339 -0.851 . . . . 0.0 109.465 -179.723 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 27.9 mmt180 -62.05 -32.89 73.45 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.282 -0.886 . . . . 0.0 109.464 -179.592 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 16.1 p -95.22 -15.23 23.4 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.258 -0.901 . . . . 0.0 109.486 -179.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 67.12 27.02 73.34 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.579 -1.408 . . . . 0.0 109.579 -179.608 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -138.19 158.0 45.17 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.198 -1.178 . . . . 0.0 109.47 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.427 ' O ' ' C ' ' A' ' 72' ' ' LEU . 19.9 ttm -91.35 132.76 35.97 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.192 -0.942 . . . . 0.0 109.543 -179.763 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.427 ' C ' ' O ' ' A' ' 71' ' ' MET . 56.1 tp . . . . . 0 N--CA 1.49 1.567 0 O-C-N 121.281 -0.887 . . . . 0.0 109.528 -179.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 84.0 mtt85 . . . . . 0 N--CA 1.49 1.568 0 CA-C-O 121.317 0.58 . . . . 0.0 109.512 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.421 ' HB2' ' CZ3' ' A' ' 8' ' ' TRP . 26.1 mmtp -100.32 98.04 8.74 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.159 -0.963 . . . . 0.0 109.532 179.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.597 HH21 ' CD ' ' A' ' 18' ' ' GLU . 85.2 mtp180 -70.66 166.2 21.28 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.173 -0.954 . . . . 0.0 109.465 -179.405 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.491 ' CG ' ' O ' ' A' ' 7' ' ' ARG . 1.3 m0 -165.8 141.9 5.15 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.235 -0.916 . . . . 0.0 109.542 -179.474 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -111.29 139.59 46.56 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.247 -0.908 . . . . 0.0 109.493 179.256 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.7 t -127.58 140.6 38.49 Favored Pre-proline 0 N--CA 1.49 1.567 0 O-C-N 121.247 -0.908 . . . . 0.0 109.505 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -51.11 -31.79 37.05 Favored 'Trans proline' 0 C--N 1.305 -1.756 0 C-N-CA 122.812 2.342 . . . . 0.0 112.157 179.333 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.407 ' HB2' ' HB2' ' A' ' 71' ' ' MET . . . -76.89 -10.73 59.57 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.164 -0.96 . . . . 0.0 109.462 -179.492 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.6 mp -90.43 116.17 65.79 Favored Pre-proline 0 N--CA 1.49 1.567 0 O-C-N 121.243 -0.911 . . . . 0.0 109.495 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . 0.415 ' O ' ' C ' ' A' ' 15' ' ' GLN . 48.6 Cg_exo -51.04 141.93 35.98 Favored 'Trans proline' 0 C--N 1.305 -1.725 0 C-N-CA 122.832 2.355 . . . . 0.0 112.244 -179.551 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.415 ' C ' ' O ' ' A' ' 14' ' ' PRO . 0.0 OUTLIER -44.64 107.17 0.09 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.249 -0.907 . . . . 0.0 109.523 -179.498 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 127.13 -23.87 5.45 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 178.725 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 24.1 m95 -80.04 139.13 37.07 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.215 -1.168 . . . . 0.0 109.46 178.748 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.597 ' CD ' HH21 ' A' ' 7' ' ' ARG . 97.0 mt-10 -127.95 150.47 49.88 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.248 -0.908 . . . . 0.0 109.432 -178.089 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.402 ' NH1' ' HA3' ' A' ' 69' ' ' GLY . 53.8 ttp180 -128.16 149.89 50.24 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.219 -0.926 . . . . 0.0 109.493 177.807 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 18.8 pt-20 -156.07 141.02 17.25 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.288 -0.883 . . . . 0.0 109.496 -179.226 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 79.6 tt0 -98.49 133.04 43.41 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.229 -0.919 . . . . 0.0 109.352 178.458 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.6 t -139.78 103.46 6.95 Favored Pre-proline 0 N--CA 1.49 1.559 0 O-C-N 121.182 -0.948 . . . . 0.0 109.533 -178.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . 0.416 ' HA ' ' HA ' ' A' ' 33' ' ' ARG . 47.1 Cg_exo -55.38 129.34 34.67 Favored 'Trans proline' 0 C--N 1.305 -1.715 0 C-N-CA 122.881 2.387 . . . . 0.0 112.203 178.685 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 . . . . . 0 N--CA 1.49 1.572 0 O-C-N 121.203 -0.936 . . . . 0.0 109.476 179.716 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 52.8 m-70 . . . . . 0 N--CA 1.489 1.521 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.416 ' HA ' ' HA ' ' A' ' 23' ' ' PRO . 99.6 mtt180 -53.67 132.39 40.76 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.229 -0.919 . . . . 0.0 109.458 179.555 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.607 ' OD1' ' N ' ' A' ' 35' ' ' VAL . 66.8 t0 -125.64 149.37 48.48 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.34 -0.85 . . . . 0.0 109.433 179.493 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.607 ' N ' ' OD1' ' A' ' 34' ' ' ASP . 64.0 t -117.06 133.75 62.82 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 O-C-N 121.247 -0.908 . . . . 0.0 109.469 -179.113 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.406 ' CZ ' ' OD2' ' A' ' 34' ' ' ASP . 96.7 m-85 -122.56 146.05 47.77 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.287 -0.883 . . . . 0.0 109.468 179.19 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.462 ' HB2' ' CE2' ' A' ' 45' ' ' PHE . 41.5 m-85 -116.07 151.34 35.74 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.262 -0.899 . . . . 0.0 109.501 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 67.5 m-85 -126.07 136.77 53.32 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.324 -0.86 . . . . 0.0 109.508 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.477 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.4 OUTLIER -98.05 178.98 1.17 Allowed Pre-proline 0 N--CA 1.49 1.547 0 O-C-N 121.285 -0.884 . . . . 0.0 109.433 179.695 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.477 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 43.0 Cg_exo -55.67 -30.21 74.35 Favored 'Trans proline' 0 C--N 1.304 -1.802 0 C-N-CA 122.779 2.32 . . . . 0.0 112.212 -179.831 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 99.8 p -87.37 4.07 44.52 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.225 -0.922 . . . . 0.0 109.488 -179.567 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 77.61 17.09 79.43 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.557 -1.417 . . . . 0.0 109.557 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.25 125.52 29.58 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.276 -1.132 . . . . 0.0 109.493 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 24.8 pttm -92.29 135.52 33.95 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.3 -0.875 . . . . 0.0 109.475 179.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.588 ' N ' ' CD1' ' A' ' 45' ' ' PHE . 1.3 p90 -140.34 146.92 39.09 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.262 -0.899 . . . . 0.0 109.416 179.714 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 19.0 ttm180 -131.56 59.36 1.7 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.241 -0.912 . . . . 0.0 109.548 179.296 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -160.92 141.65 11.47 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.234 -0.916 . . . . 0.0 109.421 -179.725 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.735 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 16.9 tptm -69.92 -37.92 8.5 Favored Pre-proline 0 N--CA 1.49 1.574 0 O-C-N 121.291 -0.881 . . . . 0.0 109.474 -179.291 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.735 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 33.6 Cg_exo -61.21 -51.24 4.68 Favored 'Trans proline' 0 C--N 1.305 -1.728 0 C-N-CA 122.866 2.378 . . . . 0.0 112.224 179.554 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -64.77 -34.9 79.42 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.257 -0.902 . . . . 0.0 109.463 179.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.542 HD23 ' O ' ' A' ' 51' ' ' LEU . 5.6 tt -62.44 -48.36 80.0 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.242 -0.911 . . . . 0.0 109.405 -179.759 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -69.91 -42.62 73.11 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.267 -0.896 . . . . 0.0 109.438 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 61.5 ttp180 -59.05 -41.37 87.76 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.389 -0.819 . . . . 0.0 109.539 179.453 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 50.4 t80 -60.0 -54.49 45.4 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.218 -0.926 . . . . 0.0 109.454 -179.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.511 HD12 HD22 ' A' ' 61' ' ' LEU . 36.3 mt -63.62 -42.07 98.22 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.199 -0.938 . . . . 0.0 109.473 179.821 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 72.73 -139.76 27.97 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -84.86 -0.1 89.11 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 78.0 p -66.43 -32.84 74.47 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.216 -1.167 . . . . 0.0 109.429 -179.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 44.4 mmm -144.42 135.78 25.5 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.213 -0.929 . . . . 0.0 109.469 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.578 ' C ' HD12 ' A' ' 61' ' ' LEU . 39.7 p-10 -93.13 112.3 24.2 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.231 -0.918 . . . . 0.0 109.551 179.326 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.578 HD12 ' C ' ' A' ' 60' ' ' ASP . 9.7 mp -117.67 14.14 14.36 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.153 -0.967 . . . . 0.0 109.507 -179.246 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 83.3 p -49.38 -34.82 17.09 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.201 -0.937 . . . . 0.0 109.49 179.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 40.3 p -100.33 36.06 1.96 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.234 -0.916 . . . . 0.0 109.435 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 80.2 t80 -105.71 129.14 53.99 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.274 -0.891 . . . . 0.0 109.497 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 55.1 t0 -86.68 118.77 26.3 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.3 -0.875 . . . . 0.0 109.456 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 65.3 t80 -81.44 -37.57 27.84 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.245 -0.909 . . . . 0.0 109.463 -179.519 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.416 HH11 ' HD3' ' A' ' 67' ' ' ARG . 24.4 mmt180 -63.95 -43.32 96.19 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.201 -0.937 . . . . 0.0 109.483 -179.054 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 71.1 p -95.61 -19.74 19.52 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.294 -0.879 . . . . 0.0 109.483 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . 0.402 ' HA3' ' NH1' ' A' ' 19' ' ' ARG . . . 67.57 53.14 26.0 Favored Glycine 0 N--CA 1.489 2.232 0 N-CA-C 109.549 -1.421 . . . . 0.0 109.549 178.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 19.8 ptmt -150.3 151.77 33.46 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.199 -1.177 . . . . 0.0 109.433 179.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.407 ' HB2' ' HB2' ' A' ' 12' ' ' ALA . 38.1 ttm -95.22 124.81 39.45 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.22 -0.925 . . . . 0.0 109.494 -179.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 60.5 tp . . . . . 0 N--CA 1.49 1.553 0 O-C-N 121.262 -0.899 . . . . 0.0 109.472 -179.603 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 66.7 ttp85 . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 40.1 mttt -103.54 107.7 18.65 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.176 -0.952 . . . . 0.0 109.442 -179.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 3.4 ptp180 -70.07 167.01 18.57 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.241 -0.912 . . . . 0.0 109.487 -179.466 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.849 ' HE1' ' H ' ' A' ' 21' ' ' GLU . 60.9 m95 -143.33 129.42 19.69 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.246 -0.909 . . . . 0.0 109.499 179.827 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -58.06 139.12 55.28 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.25 -0.907 . . . . 0.0 109.546 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -71.16 126.92 91.98 Favored Pre-proline 0 N--CA 1.491 1.589 0 O-C-N 121.237 -0.915 . . . . 0.0 109.456 -179.717 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -74.06 -59.72 0.05 OUTLIER 'Trans proline' 0 C--N 1.303 -1.818 0 C-N-CA 122.823 2.348 . . . . 0.0 112.198 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.489 ' CB ' ' SD ' ' A' ' 71' ' ' MET . . . -116.28 -28.95 6.37 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.325 -0.859 . . . . 0.0 109.476 179.322 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.462 ' C ' ' O ' ' A' ' 12' ' ' ALA . 5.3 mp -40.7 157.49 0.18 Allowed Pre-proline 0 N--CA 1.491 1.608 0 O-C-N 121.177 -0.952 . . . . 0.0 109.462 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . 0.501 ' HG2' ' CD1' ' A' ' 17' ' ' TRP . 34.0 Cg_endo -66.29 151.69 82.8 Favored 'Trans proline' 0 C--N 1.305 -1.746 0 C-N-CA 122.836 2.358 . . . . 0.0 112.205 179.042 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -58.58 123.45 16.31 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.268 -0.895 . . . . 0.0 109.498 -178.518 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 125.69 -27.14 5.26 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.489 -1.444 . . . . 0.0 109.489 178.419 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . 0.51 ' CZ2' HD21 ' A' ' 55' ' ' LEU . 15.5 m95 -84.78 143.23 29.25 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.235 -1.156 . . . . 0.0 109.441 179.585 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 75.1 tt0 -136.13 151.85 50.2 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.261 -0.899 . . . . 0.0 109.544 -178.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.494 HH11 ' HD2' ' A' ' 19' ' ' ARG . 26.5 mtm105 -121.88 163.25 19.55 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.242 -0.911 . . . . 0.0 109.445 178.373 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -155.78 128.53 7.92 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.214 -0.929 . . . . 0.0 109.492 -179.513 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.849 ' H ' ' HE1' ' A' ' 8' ' ' TRP . 92.0 mt-10 -89.8 134.19 34.32 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.278 -0.889 . . . . 0.0 109.324 178.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.524 ' O ' ' OD1' ' A' ' 34' ' ' ASP . 25.5 t -137.25 100.43 9.49 Favored Pre-proline 0 N--CA 1.49 1.557 0 O-C-N 121.225 -0.922 . . . . 0.0 109.61 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_exo -54.6 131.35 45.18 Favored 'Trans proline' 0 C--N 1.304 -1.789 0 C-N-CA 122.822 2.348 . . . . 0.0 112.207 179.001 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 84.4 mtp180 . . . . . 0 N--CA 1.491 1.588 0 O-C-N 121.206 -0.934 . . . . 0.0 109.53 179.602 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 30.3 m170 . . . . . 0 N--CA 1.49 1.542 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -113.24 133.15 55.23 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.274 -0.891 . . . . 0.0 109.556 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.524 ' OD1' ' O ' ' A' ' 22' ' ' VAL . 7.5 p30 -104.25 136.65 43.46 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.352 -0.843 . . . . 0.0 109.484 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.402 HG22 ' HG2' ' A' ' 21' ' ' GLU . 38.9 t -110.79 134.78 51.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.358 -0.839 . . . . 0.0 109.477 179.317 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -114.36 149.49 36.02 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.294 -0.878 . . . . 0.0 109.516 -179.616 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.563 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 17.1 m-85 -118.83 149.82 40.88 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.197 -0.939 . . . . 0.0 109.467 179.515 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.436 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 15.0 m-85 -129.86 140.3 51.02 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.184 -0.947 . . . . 0.0 109.616 -179.696 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.43 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -109.74 176.94 1.36 Allowed Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.266 -0.896 . . . . 0.0 109.403 179.665 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.43 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 52.2 Cg_exo -53.26 -33.27 64.53 Favored 'Trans proline' 0 C--N 1.305 -1.741 0 C-N-CA 122.872 2.382 . . . . 0.0 112.246 179.551 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 20.9 t -76.41 -5.28 46.65 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.255 -0.903 . . . . 0.0 109.475 179.603 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 80.28 15.04 79.4 Favored Glycine 0 N--CA 1.489 2.206 0 N-CA-C 109.496 -1.442 . . . . 0.0 109.496 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -78.24 124.86 28.56 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.273 -1.134 . . . . 0.0 109.461 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.8 ptmm? -95.16 121.6 36.97 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.256 -0.903 . . . . 0.0 109.586 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -142.71 155.04 44.83 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.268 -0.895 . . . . 0.0 109.477 178.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.72 ' O ' ' C ' ' A' ' 47' ' ' SER . 5.0 ptt180 -130.77 -66.71 0.75 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.271 -0.893 . . . . 0.0 109.491 179.16 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.72 ' C ' ' O ' ' A' ' 46' ' ' ARG . 1.7 m -15.82 125.91 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.337 -0.852 . . . . 0.0 109.559 179.226 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.621 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 5.1 tmtp? -59.58 -45.56 98.7 Favored Pre-proline 0 N--CA 1.491 1.617 0 O-C-N 121.296 -0.877 . . . . 0.0 109.408 -179.646 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.621 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 52.5 Cg_exo -53.85 -46.08 36.28 Favored 'Trans proline' 0 C--N 1.305 -1.755 0 C-N-CA 122.837 2.358 . . . . 0.0 112.208 -179.42 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -66.41 -35.74 81.08 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.281 -0.887 . . . . 0.0 109.536 179.347 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 62.3 tp -63.04 -45.32 92.85 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.279 -0.888 . . . . 0.0 109.477 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.627 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -67.27 -40.58 86.18 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.174 -0.954 . . . . 0.0 109.472 -179.5 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 82.6 mtp180 -60.88 -42.14 97.37 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.331 -0.855 . . . . 0.0 109.517 -179.424 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 24.5 t80 -60.99 -53.83 52.45 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.189 -0.944 . . . . 0.0 109.464 -179.713 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.521 ' O ' ' N ' ' A' ' 57' ' ' GLY . 93.2 mt -88.13 1.89 53.3 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.29 -0.881 . . . . 0.0 109.504 179.356 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . 0.627 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -44.67 94.69 0.01 OUTLIER Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.46 -1.456 . . . . 0.0 109.46 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . 0.521 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . 125.05 -52.33 0.8 Allowed Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.465 -1.454 . . . . 0.0 109.465 179.837 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.1 m -63.0 -34.6 77.89 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.213 -1.169 . . . . 0.0 109.454 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 51.6 ttp -163.98 157.81 18.92 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.251 -0.906 . . . . 0.0 109.465 -179.576 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.403 ' C ' HD22 ' A' ' 61' ' ' LEU . 51.4 t0 -89.38 110.26 21.09 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.252 -0.905 . . . . 0.0 109.512 -179.688 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.534 ' N ' HD22 ' A' ' 61' ' ' LEU . 4.0 mm? -93.78 -3.76 51.51 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.267 -0.896 . . . . 0.0 109.469 -179.733 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 38.4 t -59.45 -39.49 83.77 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.216 -0.927 . . . . 0.0 109.395 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 65.9 p -86.71 14.55 6.87 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.182 -0.949 . . . . 0.0 109.424 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -91.55 129.64 37.5 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.177 -0.952 . . . . 0.0 109.462 -179.836 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.52 ' O ' ' N ' ' A' ' 69' ' ' GLY . 60.9 t0 -80.03 112.19 17.1 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.196 -0.94 . . . . 0.0 109.472 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.563 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 48.2 t80 -75.13 -44.15 48.59 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.233 -0.917 . . . . 0.0 109.468 -179.006 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.418 ' HD2' ' N ' ' A' ' 67' ' ' ARG . 10.9 mpt_? -60.34 -42.52 95.88 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.198 -0.939 . . . . 0.0 109.518 -178.794 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . 0.482 ' OG1' ' CG ' ' A' ' 65' ' ' ASP . 30.0 p -97.83 -13.85 21.08 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.302 -0.874 . . . . 0.0 109.497 -179.459 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . 0.52 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 63.25 39.47 97.92 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.481 -1.448 . . . . 0.0 109.481 -179.841 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.438 ' H ' ' HB3' ' A' ' 65' ' ' ASP . 51.4 mttp -137.35 156.55 48.09 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.223 -1.163 . . . . 0.0 109.461 -179.487 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.489 ' SD ' ' CB ' ' A' ' 12' ' ' ALA . 37.2 mtt -84.95 148.47 26.2 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.199 -0.938 . . . . 0.0 109.442 -180.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 56.0 tp . . . . . 0 N--CA 1.49 1.546 0 O-C-N 121.282 -0.886 . . . . 0.0 109.446 179.967 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 35.3 ptt180 . . . . . 0 N--CA 1.489 1.517 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.437 ' HD3' ' N ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -114.39 113.09 24.05 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.244 -0.91 . . . . 0.0 109.442 179.883 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.52 ' NH2' ' OE1' ' A' ' 18' ' ' GLU . 69.4 mtp85 -72.01 168.06 18.84 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.273 -0.892 . . . . 0.0 109.38 -179.932 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.59 ' N ' ' O ' ' A' ' 19' ' ' ARG . 53.0 m95 -136.28 124.7 23.42 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.197 -0.939 . . . . 0.0 109.427 -179.418 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.521 ' N ' ' OE1' ' A' ' 9' ' ' GLU . 58.5 mp0 -90.78 117.07 29.12 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.279 -0.888 . . . . 0.0 109.398 179.769 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.419 ' SG ' ' HB3' ' A' ' 12' ' ' ALA . 46.4 t -119.24 100.32 50.15 Favored Pre-proline 0 N--CA 1.491 1.608 0 O-C-N 121.34 -0.85 . . . . 0.0 109.522 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_exo -55.2 -25.44 46.38 Favored 'Trans proline' 0 C--N 1.305 -1.749 0 C-N-CA 122.945 2.43 . . . . 0.0 112.19 178.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.455 ' HB1' ' SD ' ' A' ' 71' ' ' MET . . . -57.45 -35.08 69.65 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.267 -0.895 . . . . 0.0 109.47 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.671 HD22 ' N ' ' A' ' 13' ' ' LEU . 3.2 mm? -89.97 154.9 47.64 Favored Pre-proline 0 N--CA 1.49 1.555 0 O-C-N 121.201 -0.937 . . . . 0.0 109.402 179.793 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_exo -52.1 146.7 29.4 Favored 'Trans proline' 0 C--N 1.306 -1.709 0 C-N-CA 122.78 2.32 . . . . 0.0 112.231 179.064 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 8.7 mp0 -55.29 124.08 15.89 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.252 -0.905 . . . . 0.0 109.509 -179.757 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 124.31 -22.47 6.64 Favored Glycine 0 N--CA 1.49 2.243 0 N-CA-C 109.647 -1.381 . . . . 0.0 109.647 179.427 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 52.4 m95 -85.36 136.16 33.59 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.177 -1.19 . . . . 0.0 109.473 179.205 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.52 ' OE1' ' NH2' ' A' ' 7' ' ' ARG . 72.4 mt-10 -142.41 155.7 45.14 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.326 -0.859 . . . . 0.0 109.424 -179.126 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.615 HH22 ' CD2' ' A' ' 13' ' ' LEU . 0.0 OUTLIER -138.56 140.24 38.97 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.211 -0.93 . . . . 0.0 109.399 178.953 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -132.89 142.59 49.0 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.241 -0.912 . . . . 0.0 109.481 -178.365 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.521 ' HG3' ' HE1' ' A' ' 8' ' ' TRP . 92.4 mt-10 -98.99 142.58 30.3 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.376 -0.827 . . . . 0.0 109.392 178.391 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 10.4 t -145.17 123.39 6.53 Favored Pre-proline 0 N--CA 1.491 1.598 0 O-C-N 121.219 -0.925 . . . . 0.0 109.611 -179.535 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -74.84 135.55 19.56 Favored 'Trans proline' 0 C--N 1.304 -1.813 0 C-N-CA 122.879 2.386 . . . . 0.0 112.214 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 78.3 mtp85 . . . . . 0 N--CA 1.49 1.569 0 O-C-N 121.273 -0.892 . . . . 0.0 109.484 179.652 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 33.2 m170 . . . . . 0 N--CA 1.49 1.539 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -114.98 128.04 56.04 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.245 -0.909 . . . . 0.0 109.518 -179.52 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 22.7 m-20 -106.92 137.42 45.01 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.211 -0.931 . . . . 0.0 109.419 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.426 HG22 ' HG2' ' A' ' 21' ' ' GLU . 3.0 t -106.91 135.03 46.83 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.246 -0.909 . . . . 0.0 109.411 179.577 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -113.7 141.54 47.11 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.313 -0.867 . . . . 0.0 109.524 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.709 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 17.5 m-85 -114.36 142.05 46.83 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.281 -0.887 . . . . 0.0 109.357 -179.352 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 86.2 m-85 -123.06 135.09 54.27 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.307 -0.871 . . . . 0.0 109.47 -179.607 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.454 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -97.2 177.56 1.63 Allowed Pre-proline 0 N--CA 1.491 1.592 0 O-C-N 121.191 -0.943 . . . . 0.0 109.426 179.593 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.454 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 47.4 Cg_exo -54.49 -31.37 68.78 Favored 'Trans proline' 0 C--N 1.304 -1.809 0 C-N-CA 122.848 2.365 . . . . 0.0 112.258 -179.656 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 71.8 m -88.62 7.08 35.21 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.316 -0.865 . . . . 0.0 109.476 179.561 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 79.95 10.7 85.33 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 -179.584 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -64.22 122.75 17.37 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.168 -1.195 . . . . 0.0 109.457 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 13.5 ptpt -95.88 126.88 41.44 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.242 -0.911 . . . . 0.0 109.525 178.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.634 ' N ' ' CD1' ' A' ' 45' ' ' PHE . 1.1 p90 -139.92 146.46 39.24 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.296 -0.877 . . . . 0.0 109.47 -179.919 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 28.4 ptt-85 -134.79 53.59 1.98 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.3 -0.875 . . . . 0.0 109.549 179.213 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.4 p -159.41 144.71 15.77 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.285 -0.884 . . . . 0.0 109.563 -179.824 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.666 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 0.6 OUTLIER -69.39 -42.29 20.06 Favored Pre-proline 0 N--CA 1.49 1.545 0 O-C-N 121.211 -0.931 . . . . 0.0 109.4 -179.473 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.666 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 42.9 Cg_exo -57.54 -48.98 14.83 Favored 'Trans proline' 0 C--N 1.305 -1.752 0 C-N-CA 122.898 2.399 . . . . 0.0 112.231 -179.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.434 HE21 ' HB2' ' A' ' 45' ' ' PHE . 18.3 tt0 -65.84 -38.07 87.89 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.275 -0.891 . . . . 0.0 109.388 179.54 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.516 HD13 ' CE2' ' A' ' 45' ' ' PHE . 37.0 tp -64.02 -45.41 89.02 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.274 -0.891 . . . . 0.0 109.493 -179.636 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.591 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -65.86 -43.98 86.77 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.262 -0.899 . . . . 0.0 109.425 -179.665 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 15.1 tpp180 -56.06 -42.88 77.33 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.251 -0.905 . . . . 0.0 109.448 -179.419 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 56.2 t80 -61.1 -52.14 66.17 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.207 -0.933 . . . . 0.0 109.387 -179.215 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.496 HD12 ' O ' ' A' ' 56' ' ' GLY . 2.5 pp -86.9 0.94 54.14 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.228 -0.92 . . . . 0.0 109.492 179.718 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . 0.591 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . 44.17 -121.8 4.06 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 -179.743 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -110.01 31.71 7.27 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.595 -1.402 . . . . 0.0 109.595 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 38.2 t -87.82 -21.11 25.25 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.228 -1.16 . . . . 0.0 109.458 -179.579 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 63.8 mmm -139.07 130.39 26.93 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.173 -0.954 . . . . 0.0 109.454 -179.64 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 63.0 t0 -90.79 106.38 18.47 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.272 -0.893 . . . . 0.0 109.479 179.191 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.416 ' O ' ' C ' ' A' ' 62' ' ' SER . 98.6 mt -93.47 4.44 53.95 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.23 -0.919 . . . . 0.0 109.487 -179.308 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.416 ' C ' ' O ' ' A' ' 61' ' ' LEU . 39.7 t -42.9 -39.71 2.66 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.285 -0.884 . . . . 0.0 109.484 179.577 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 67.9 p -98.57 48.39 0.98 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.238 -0.914 . . . . 0.0 109.417 179.345 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -124.25 131.0 53.5 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.299 -0.875 . . . . 0.0 109.482 -179.499 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.459 ' CG ' ' OG1' ' A' ' 68' ' ' THR . 55.7 t0 -89.94 104.59 17.14 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.125 -0.984 . . . . 0.0 109.463 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.709 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 68.2 t80 -74.16 -49.34 24.04 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.195 -0.94 . . . . 0.0 109.501 -179.231 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 19.0 mmm180 -51.43 -37.6 49.45 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.171 -0.956 . . . . 0.0 109.449 -179.624 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . 0.459 ' OG1' ' CG ' ' A' ' 65' ' ' ASP . 22.3 p -100.45 -11.21 20.38 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.265 -0.897 . . . . 0.0 109.481 -179.881 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 62.12 34.23 88.37 Favored Glycine 0 N--CA 1.491 2.361 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 179.768 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 62.0 mttp -127.86 147.38 50.45 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.215 -1.167 . . . . 0.0 109.475 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.455 ' SD ' ' HB1' ' A' ' 12' ' ' ALA . 3.6 tpt -77.87 140.26 39.32 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.184 -0.947 . . . . 0.0 109.513 179.774 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 60.4 tp . . . . . 0 N--CA 1.49 1.548 0 O-C-N 121.222 -0.924 . . . . 0.0 109.458 179.87 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 88.1 mtm180 . . . . . 0 N--CA 1.49 1.552 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.532 ' HB2' ' H ' ' A' ' 21' ' ' GLU . 11.3 mptt -76.06 139.97 41.67 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.365 -0.835 . . . . 0.0 109.521 179.742 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -157.44 92.3 1.22 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.265 -0.897 . . . . 0.0 109.508 -179.558 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.657 ' HE1' ' HE ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -122.27 149.22 44.01 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.19 -0.944 . . . . 0.0 109.509 179.304 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -62.7 150.83 40.04 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.276 -0.89 . . . . 0.0 109.505 179.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.448 ' SG ' ' C ' ' A' ' 18' ' ' GLU . 10.9 m -93.45 114.3 62.51 Favored Pre-proline 0 N--CA 1.492 1.644 0 O-C-N 121.251 -0.906 . . . . 0.0 109.517 -179.644 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -76.87 -39.4 0.65 Allowed 'Trans proline' 0 C--N 1.306 -1.689 0 C-N-CA 122.821 2.347 . . . . 0.0 112.233 179.389 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.406 ' C ' HD22 ' A' ' 13' ' ' LEU . . . -66.17 -36.39 82.98 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.211 -0.931 . . . . 0.0 109.554 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.702 HD22 ' N ' ' A' ' 13' ' ' LEU . 3.4 mm? -88.23 156.91 51.26 Favored Pre-proline 0 N--CA 1.49 1.555 0 O-C-N 121.17 -0.956 . . . . 0.0 109.452 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -52.2 142.79 44.61 Favored 'Trans proline' 0 C--N 1.306 -1.692 0 C-N-CA 122.802 2.334 . . . . 0.0 112.154 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 98.5 mm-40 -47.09 131.96 12.36 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.189 -0.944 . . . . 0.0 109.465 -179.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 120.61 -21.65 8.47 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 179.847 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . 0.413 ' CH2' HD11 ' A' ' 55' ' ' LEU . 18.1 m95 -84.47 147.89 26.84 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.133 -1.216 . . . . 0.0 109.473 179.688 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.448 ' C ' ' SG ' ' A' ' 10' ' ' CYS . 94.1 mt-10 -127.51 148.14 50.32 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.274 -0.891 . . . . 0.0 109.42 -178.679 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.657 ' HE ' ' HE1' ' A' ' 8' ' ' TRP . 52.0 ttp180 -130.83 126.22 35.69 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.249 -0.907 . . . . 0.0 109.474 179.51 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -129.63 139.03 51.53 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.227 -0.921 . . . . 0.0 109.499 -179.537 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.532 ' H ' ' HB2' ' A' ' 6' ' ' LYS . 77.9 tt0 -101.51 145.63 28.74 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.325 -0.859 . . . . 0.0 109.362 179.06 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.5 t -142.56 121.82 7.74 Favored Pre-proline 0 N--CA 1.49 1.572 0 O-C-N 121.115 -0.991 . . . . 0.0 109.54 -179.159 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -78.73 144.57 19.59 Favored 'Trans proline' 0 C--N 1.305 -1.755 0 C-N-CA 122.797 2.331 . . . . 0.0 112.161 178.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.81 ' NE ' ' H ' ' A' ' 24' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.564 0 O-C-N 121.181 -0.949 . . . . 0.0 109.489 179.563 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . 0.595 ' O ' ' NE ' ' A' ' 24' ' ' ARG . 75.7 m80 . . . . . 0 N--CA 1.491 1.58 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 7.4 mtp180 -112.08 118.82 36.46 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.218 -0.927 . . . . 0.0 109.492 179.554 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -91.96 139.49 30.6 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.235 -0.916 . . . . 0.0 109.394 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.6 t -106.7 123.03 61.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.271 -0.893 . . . . 0.0 109.405 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -107.36 140.61 40.02 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.208 -0.933 . . . . 0.0 109.47 179.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.544 ' CD1' ' CE1' ' A' ' 66' ' ' PHE . 71.9 m-85 -109.4 142.25 40.62 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.251 -0.906 . . . . 0.0 109.471 -179.216 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 80.2 m-85 -126.39 139.29 53.39 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.242 -0.911 . . . . 0.0 109.496 -179.742 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.405 ' CB ' ' HD2' ' A' ' 40' ' ' PRO . 0.4 OUTLIER -99.7 165.22 15.07 Favored Pre-proline 0 N--CA 1.49 1.568 0 O-C-N 121.362 -0.836 . . . . 0.0 109.443 179.53 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.405 ' HD2' ' CB ' ' A' ' 39' ' ' SER . 20.5 Cg_endo -60.47 -19.1 57.59 Favored 'Trans proline' 0 C--N 1.305 -1.747 0 C-N-CA 122.805 2.337 . . . . 0.0 112.201 179.833 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 56.7 p -88.52 0.04 56.73 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.361 -0.837 . . . . 0.0 109.511 179.411 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 85.6 13.11 70.91 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -78.21 117.66 19.7 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.204 -1.174 . . . . 0.0 109.479 -179.773 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.75 ' HZ3' HH11 ' A' ' 46' ' ' ARG . 62.8 tttm -92.81 128.37 38.64 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.295 -0.878 . . . . 0.0 109.402 178.689 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.635 ' N ' ' CD1' ' A' ' 45' ' ' PHE . 1.1 p90 -140.24 146.8 39.12 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.202 -0.936 . . . . 0.0 109.479 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.75 HH11 ' HZ3' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -141.7 59.78 1.49 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.218 -0.926 . . . . 0.0 109.525 179.008 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.1 t -157.73 144.97 18.29 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.231 -0.918 . . . . 0.0 109.568 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.603 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 3.8 tttt -68.5 -46.06 36.23 Favored Pre-proline 0 N--CA 1.49 1.575 0 O-C-N 121.176 -0.953 . . . . 0.0 109.437 -179.355 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.603 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 45.6 Cg_exo -55.77 -46.72 29.59 Favored 'Trans proline' 0 C--N 1.306 -1.695 0 C-N-CA 122.77 2.314 . . . . 0.0 112.23 -179.689 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -67.16 -39.94 86.57 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.208 -0.933 . . . . 0.0 109.447 179.794 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 57.0 tp -64.87 -45.81 84.44 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.252 -0.905 . . . . 0.0 109.497 -179.476 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.691 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -69.98 -45.3 67.63 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.271 -0.893 . . . . 0.0 109.474 -179.288 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 77.5 ttt-85 -60.18 -43.52 95.78 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.2 -0.938 . . . . 0.0 109.545 -179.697 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 37.5 t80 -62.43 -55.61 26.06 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.293 -0.879 . . . . 0.0 109.518 -179.114 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.488 ' CD1' HD12 ' A' ' 13' ' ' LEU . 96.4 mt -90.34 4.92 49.4 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.202 -0.936 . . . . 0.0 109.532 179.885 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . 0.691 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -48.6 -77.37 0.12 Allowed Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 -179.643 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.09 7.47 0.2 Allowed Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 -179.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.577 ' H ' ' C ' ' A' ' 56' ' ' GLY . 3.6 p -108.77 -26.85 10.09 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.209 -1.171 . . . . 0.0 109.498 -179.61 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.629 ' SD ' HD21 ' A' ' 61' ' ' LEU . 18.1 ptm -176.2 170.13 2.68 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.192 -0.942 . . . . 0.0 109.431 -179.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.518 ' O ' ' OD1' ' A' ' 60' ' ' ASP . 45.3 p-10 -97.24 116.47 29.51 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.317 -0.865 . . . . 0.0 109.452 179.655 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.629 HD21 ' SD ' ' A' ' 59' ' ' MET . 88.5 mt -111.8 16.45 20.45 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.352 -0.843 . . . . 0.0 109.463 -179.414 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 41.0 t -58.77 -39.28 80.57 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.284 -0.885 . . . . 0.0 109.436 -179.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 51.7 p -92.03 23.98 3.48 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.357 -0.84 . . . . 0.0 109.413 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 46.5 t80 -99.72 125.71 45.65 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.248 -0.907 . . . . 0.0 109.476 -179.729 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.437 ' OD2' ' OG1' ' A' ' 68' ' ' THR . 55.3 t0 -83.63 119.31 24.6 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.261 -0.899 . . . . 0.0 109.418 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.544 ' CE1' ' CD1' ' A' ' 37' ' ' TYR . 73.8 t80 -83.02 -33.23 26.55 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.235 -0.916 . . . . 0.0 109.541 -179.541 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 42.3 ttm180 -66.18 -43.94 85.43 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.264 -0.897 . . . . 0.0 109.529 -179.214 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . 0.631 ' O ' ' NH1' ' A' ' 19' ' ' ARG . 11.3 p -96.47 -15.91 21.45 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.278 -0.889 . . . . 0.0 109.503 -179.867 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . 0.52 ' HA3' HH11 ' A' ' 19' ' ' ARG . . . 64.52 60.45 7.02 Favored Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.497 -1.441 . . . . 0.0 109.497 179.375 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -152.96 149.74 28.52 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.318 -1.107 . . . . 0.0 109.423 179.599 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 34.6 ttm -91.63 121.41 33.27 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.208 -0.932 . . . . 0.0 109.522 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.54 ' C ' HD23 ' A' ' 72' ' ' LEU . 3.4 tt . . . . . 0 N--CA 1.491 1.598 0 O-C-N 121.278 -0.889 . . . . 0.0 109.458 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.7 ptp180 . . . . . 0 N--CA 1.49 1.549 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.585 ' NZ ' ' O ' ' A' ' 21' ' ' GLU . 0.3 OUTLIER -120.68 123.35 42.53 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.294 -0.879 . . . . 0.0 109.526 179.948 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 83.7 mtp180 -100.66 108.44 20.32 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.246 -0.909 . . . . 0.0 109.501 -179.306 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 15.2 m0 -104.37 169.71 8.32 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.212 -0.93 . . . . 0.0 109.472 178.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -88.83 146.04 25.21 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.212 -0.93 . . . . 0.0 109.408 -179.661 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 17.8 t -121.34 100.73 44.67 Favored Pre-proline 0 N--CA 1.489 1.484 0 O-C-N 121.247 -0.908 . . . . 0.0 109.499 179.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -53.11 -40.18 77.7 Favored 'Trans proline' 0 C--N 1.304 -1.776 0 C-N-CA 122.864 2.376 . . . . 0.0 112.23 -179.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.42 -28.95 60.9 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.262 -0.899 . . . . 0.0 109.52 -179.725 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 14.5 mt -91.67 151.38 42.31 Favored Pre-proline 0 N--CA 1.49 1.53 0 O-C-N 121.302 -0.874 . . . . 0.0 109.436 -179.757 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -51.1 154.6 7.34 Favored 'Trans proline' 0 C--N 1.306 -1.709 0 C-N-CA 122.746 2.297 . . . . 0.0 112.256 179.029 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 89.5 mt-30 -58.25 121.02 9.73 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.254 -0.904 . . . . 0.0 109.477 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 124.52 -36.19 2.97 Favored Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 -179.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . 0.432 ' CZ2' HD11 ' A' ' 55' ' ' LEU . 37.5 m95 -74.61 149.02 40.22 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.219 -1.165 . . . . 0.0 109.453 178.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -139.46 153.35 47.53 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.139 -0.976 . . . . 0.0 109.489 -178.437 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.552 ' NH1' ' O ' ' A' ' 68' ' ' THR . 60.8 ttp180 -106.56 156.44 18.58 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.179 -0.951 . . . . 0.0 109.423 178.544 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.408 ' N ' ' HG2' ' A' ' 19' ' ' ARG . 39.2 tt0 -142.53 140.53 31.84 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.226 -0.921 . . . . 0.0 109.557 -178.572 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.585 ' O ' ' NZ ' ' A' ' 6' ' ' LYS . 81.2 mm-40 -113.92 121.04 42.74 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.187 -0.945 . . . . 0.0 109.407 178.004 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 39.2 t -128.79 133.78 25.58 Favored Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.215 -0.928 . . . . 0.0 109.609 -178.671 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -76.47 171.45 18.04 Favored 'Trans proline' 0 C--N 1.306 -1.703 0 C-N-CA 122.825 2.35 . . . . 0.0 112.221 178.21 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.548 ' NE ' ' OD2' ' A' ' 34' ' ' ASP . 12.7 mmt85 . . . . . 0 N--CA 1.49 1.56 0 O-C-N 121.333 -0.854 . . . . 0.0 109.366 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 36.2 m80 . . . . . 0 N--CA 1.489 1.515 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 19.1 ptp180 -128.94 150.75 50.25 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.212 -0.93 . . . . 0.0 109.493 -179.491 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.548 ' OD2' ' NE ' ' A' ' 24' ' ' ARG . 69.5 m-20 -129.68 146.24 51.47 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.264 -0.897 . . . . 0.0 109.454 179.497 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.473 HG22 ' OE1' ' A' ' 21' ' ' GLU . 33.3 t -105.06 132.4 51.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.225 -0.922 . . . . 0.0 109.446 -179.258 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 81.3 m-85 -122.75 152.45 40.61 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.161 -0.962 . . . . 0.0 109.505 179.137 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 68.0 m-85 -123.87 149.29 45.97 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.193 -0.942 . . . . 0.0 109.49 -179.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 53.5 m-85 -116.08 128.19 55.48 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.263 -0.898 . . . . 0.0 109.643 -179.397 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.535 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.5 OUTLIER -92.61 -177.94 0.8 Allowed Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.299 -0.876 . . . . 0.0 109.444 179.195 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.535 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 51.2 Cg_exo -55.37 -31.44 77.36 Favored 'Trans proline' 0 C--N 1.305 -1.746 0 C-N-CA 122.885 2.39 . . . . 0.0 112.248 -179.544 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.452 ' O ' ' OG ' ' A' ' 41' ' ' SER . 0.1 OUTLIER -93.05 11.81 26.28 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.184 -0.947 . . . . 0.0 109.528 179.019 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 73.66 14.85 79.54 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 -179.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 5.6 ttmt -64.36 128.73 37.05 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.175 -1.191 . . . . 0.0 109.44 -179.504 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 9.8 mtpm? -94.45 118.09 31.12 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.282 -0.886 . . . . 0.0 109.455 178.685 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 55.0 p90 -139.4 146.21 39.89 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.284 -0.885 . . . . 0.0 109.44 -179.638 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 26.6 ptt180 -126.32 57.78 1.39 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.336 -0.852 . . . . 0.0 109.493 179.345 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.5 t -150.45 130.33 13.33 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.236 -0.915 . . . . 0.0 109.504 179.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.852 ' N ' ' HD2' ' A' ' 49' ' ' PRO . 7.6 tmtt? -63.48 -46.81 84.17 Favored Pre-proline 0 N--CA 1.49 1.533 0 O-C-N 121.222 -0.924 . . . . 0.0 109.503 -179.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.852 ' HD2' ' N ' ' A' ' 48' ' ' LYS . 18.3 Cg_endo -57.95 -37.08 97.43 Favored 'Trans proline' 0 C--N 1.305 -1.734 0 C-N-CA 122.812 2.341 . . . . 0.0 112.235 178.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 59.2 tt0 -67.66 -38.28 83.57 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.207 -0.933 . . . . 0.0 109.478 179.277 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.698 HD23 ' O ' ' A' ' 51' ' ' LEU . 2.0 tt -63.64 -42.32 98.14 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.26 -0.9 . . . . 0.0 109.505 -179.817 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.89 -39.75 90.94 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.28 -0.888 . . . . 0.0 109.491 -179.551 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 13.6 tpp180 -55.9 -45.98 78.48 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.254 -0.904 . . . . 0.0 109.521 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -62.59 -47.87 81.9 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.24 -0.913 . . . . 0.0 109.484 179.537 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.432 HD11 ' CZ2' ' A' ' 17' ' ' TRP . 8.1 mp -65.26 -0.59 1.84 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.291 -0.88 . . . . 0.0 109.437 179.504 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . 0.551 ' O ' ' C ' ' A' ' 57' ' ' GLY . . . 56.37 60.36 9.09 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.616 -1.394 . . . . 0.0 109.616 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . 0.551 ' C ' ' O ' ' A' ' 56' ' ' GLY . . . 34.34 38.41 0.11 Allowed Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 -179.351 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.468 ' N ' ' O ' ' A' ' 56' ' ' GLY . 89.0 p -88.95 -0.89 57.79 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.294 -1.121 . . . . 0.0 109.436 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.499 ' CE ' HD21 ' A' ' 61' ' ' LEU . 33.1 ttp -155.46 148.74 24.82 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.224 -0.922 . . . . 0.0 109.548 -179.736 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 55.1 t0 -85.76 101.81 13.11 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.232 -0.917 . . . . 0.0 109.482 -179.585 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.499 HD21 ' CE ' ' A' ' 59' ' ' MET . 89.1 mt -96.41 1.18 51.47 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.258 -0.901 . . . . 0.0 109.449 179.56 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 58.6 m -54.93 -27.19 41.49 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.143 -0.973 . . . . 0.0 109.458 179.585 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 36.1 p -94.11 1.46 56.13 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.27 -0.894 . . . . 0.0 109.547 179.563 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.435 ' CZ ' ' HA2' ' A' ' 69' ' ' GLY . 72.9 t80 -87.87 114.52 24.56 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.247 -0.908 . . . . 0.0 109.512 179.459 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -76.23 136.81 39.69 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.268 -0.895 . . . . 0.0 109.465 -179.498 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 69.4 t80 -89.15 -37.34 15.13 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.144 -0.972 . . . . 0.0 109.44 179.446 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 29.0 tpt85 -59.35 -44.44 92.67 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.278 -0.889 . . . . 0.0 109.461 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . 0.552 ' O ' ' NH1' ' A' ' 19' ' ' ARG . 33.1 p -97.54 -20.53 17.65 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.324 -0.86 . . . . 0.0 109.485 179.659 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . 0.457 ' HA3' HH11 ' A' ' 19' ' ' ARG . . . 67.21 31.46 77.47 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.56 -1.416 . . . . 0.0 109.56 179.667 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.407 ' HZ2' HH12 ' A' ' 19' ' ' ARG . 64.6 mttp -132.11 152.58 51.15 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.232 -1.157 . . . . 0.0 109.525 -179.655 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 17.4 mtt -78.73 144.53 35.16 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.211 -0.931 . . . . 0.0 109.466 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.661 ' C ' HD23 ' A' ' 72' ' ' LEU . 5.1 tt . . . . . 0 N--CA 1.49 1.564 0 O-C-N 121.213 -0.929 . . . . 0.0 109.413 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.584 ' NH2' ' OE2' ' A' ' 20' ' ' GLU . 50.0 mtp180 . . . . . 0 N--CA 1.489 1.516 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.425 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 10.9 mptt -74.68 158.29 33.84 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.304 -0.872 . . . . 0.0 109.452 -179.0 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 79.8 mtp180 -150.92 140.26 21.37 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.246 -0.909 . . . . 0.0 109.456 -179.171 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.589 ' N ' ' CD1' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -167.75 140.88 3.31 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.228 -0.92 . . . . 0.0 109.389 179.213 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -87.68 136.13 33.08 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.168 -0.957 . . . . 0.0 109.465 178.586 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 32.8 m -94.03 141.05 23.16 Favored Pre-proline 0 N--CA 1.489 1.511 0 O-C-N 121.149 -0.969 . . . . 0.0 109.505 -179.701 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -70.27 -14.81 34.89 Favored 'Trans proline' 0 C--N 1.304 -1.773 0 C-N-CA 122.893 2.396 . . . . 0.0 112.249 179.713 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.4 ' HB2' ' SD ' ' A' ' 71' ' ' MET . . . -90.78 -11.71 38.64 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.206 -0.934 . . . . 0.0 109.483 179.835 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 7.7 mp -99.71 148.95 35.46 Favored Pre-proline 0 N--CA 1.49 1.553 0 O-C-N 121.183 -0.948 . . . . 0.0 109.456 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . 0.408 ' HG2' ' CD1' ' A' ' 17' ' ' TRP . 47.2 Cg_endo -70.21 148.88 63.15 Favored 'Trans proline' 0 C--N 1.305 -1.738 0 C-N-CA 122.858 2.372 . . . . 0.0 112.213 178.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -52.97 129.31 30.12 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.313 -0.867 . . . . 0.0 109.52 -179.463 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 122.84 -25.09 6.56 Favored Glycine 0 N--CA 1.489 2.211 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 179.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . 0.434 ' N ' ' CD1' ' A' ' 17' ' ' TRP . 14.1 m95 -86.76 152.11 22.8 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.226 -1.161 . . . . 0.0 109.479 179.652 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -129.48 147.13 51.26 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.165 -0.96 . . . . 0.0 109.545 -179.422 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.553 ' NH1' ' NE1' ' A' ' 8' ' ' TRP . 75.0 ttt-85 -128.23 125.74 39.55 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.231 -0.918 . . . . 0.0 109.432 179.581 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.588 ' OE2' ' CE1' ' A' ' 38' ' ' TYR . 21.8 pt-20 -134.1 139.34 45.87 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.201 -0.937 . . . . 0.0 109.461 -179.553 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -101.55 151.3 22.14 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.278 -0.888 . . . . 0.0 109.4 -179.778 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.1 t -136.14 122.52 13.99 Favored Pre-proline 0 N--CA 1.491 1.578 0 O-C-N 121.226 -0.921 . . . . 0.0 109.518 -179.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . 0.414 ' CB ' ' NH1' ' A' ' 33' ' ' ARG . 62.0 Cg_endo -77.01 140.14 19.88 Favored 'Trans proline' 0 C--N 1.306 -1.689 0 C-N-CA 122.814 2.342 . . . . 0.0 112.109 -178.766 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 38.5 ttm180 . . . . . 0 N--CA 1.491 1.585 0 O-C-N 121.157 -0.964 . . . . 0.0 109.522 178.5 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . 0.676 ' C ' ' HE ' ' A' ' 33' ' ' ARG . 58.4 m80 . . . . . 0 N--CA 1.492 1.639 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.676 ' HE ' ' C ' ' A' ' 32' ' ' HIS . 0.4 OUTLIER -107.49 107.82 18.85 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.252 -0.905 . . . . 0.0 109.481 -179.261 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.511 ' OD1' ' N ' ' A' ' 35' ' ' VAL . 58.4 t0 -77.8 134.94 37.91 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.303 -0.873 . . . . 0.0 109.505 179.41 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.511 ' N ' ' OD1' ' A' ' 34' ' ' ASP . 47.1 t -105.45 128.13 59.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.247 -0.908 . . . . 0.0 109.47 -179.796 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.418 ' CZ ' ' OD2' ' A' ' 34' ' ' ASP . 72.7 m-85 -115.14 142.89 46.05 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.172 -0.955 . . . . 0.0 109.427 179.251 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.409 ' HB2' ' CE2' ' A' ' 45' ' ' PHE . 52.8 m-85 -111.22 142.73 43.03 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.273 -0.892 . . . . 0.0 109.462 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.588 ' CE1' ' OE2' ' A' ' 20' ' ' GLU . 19.9 m-85 -118.14 135.85 53.97 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.251 -0.905 . . . . 0.0 109.445 179.793 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.438 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -94.26 176.88 2.13 Favored Pre-proline 0 N--CA 1.49 1.551 0 O-C-N 121.231 -0.918 . . . . 0.0 109.474 179.55 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.438 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 42.1 Cg_exo -55.47 -29.88 71.07 Favored 'Trans proline' 0 C--N 1.304 -1.795 0 C-N-CA 122.897 2.398 . . . . 0.0 112.243 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 66.8 m -91.05 -2.29 57.67 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.176 -0.952 . . . . 0.0 109.548 -179.396 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 88.32 22.1 42.27 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.556 -1.418 . . . . 0.0 109.556 179.748 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.482 ' HE3' HE22 ' A' ' 50' ' ' GLN . 46.9 tttp -75.06 129.13 37.08 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.273 -1.133 . . . . 0.0 109.421 -179.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 47.5 mtpt -94.27 120.87 35.14 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.263 -0.898 . . . . 0.0 109.531 179.301 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.599 ' N ' ' CD1' ' A' ' 45' ' ' PHE . 2.0 p90 -141.68 150.63 42.13 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.197 -0.939 . . . . 0.0 109.389 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 10.6 ptm180 -143.04 68.94 1.3 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.331 -0.855 . . . . 0.0 109.453 179.194 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -148.1 129.45 14.77 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.179 -0.951 . . . . 0.0 109.439 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.639 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -61.2 -42.95 88.52 Favored Pre-proline 0 N--CA 1.488 1.448 0 O-C-N 121.209 -0.932 . . . . 0.0 109.461 -179.33 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.639 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 32.0 Cg_exo -58.2 -40.26 77.93 Favored 'Trans proline' 0 C--N 1.305 -1.752 0 C-N-CA 122.845 2.363 . . . . 0.0 112.242 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.482 HE22 ' HE3' ' A' ' 43' ' ' LYS . 59.5 tt0 -65.79 -38.86 90.15 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.29 -0.881 . . . . 0.0 109.516 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.443 HD11 ' CE2' ' A' ' 45' ' ' PHE . 8.9 mp -65.29 -45.53 84.04 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.223 -0.923 . . . . 0.0 109.46 -179.667 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.667 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -72.35 -48.08 44.64 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.337 -0.852 . . . . 0.0 109.515 -179.379 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 80.1 mtp180 -58.9 -32.52 69.59 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.203 -0.936 . . . . 0.0 109.473 -179.413 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 24.2 t80 -86.01 -55.08 4.11 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.301 -0.875 . . . . 0.0 109.446 -178.55 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.404 ' O ' ' C ' ' A' ' 56' ' ' GLY . 95.2 mt -93.85 6.2 49.18 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.263 -0.898 . . . . 0.0 109.411 -178.217 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . 0.667 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -45.55 -72.29 0.39 Allowed Glycine 0 N--CA 1.492 2.374 0 N-CA-C 109.475 -1.45 . . . . 0.0 109.475 -179.599 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -57.41 -43.7 93.82 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 -179.016 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 54.1 p -58.2 -34.64 70.59 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.243 -1.151 . . . . 0.0 109.44 -179.344 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.404 ' N ' ' O ' ' A' ' 55' ' ' LEU . 1.7 mmm -170.53 162.82 8.23 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.33 -0.856 . . . . 0.0 109.472 -179.61 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 56.2 t0 -95.42 114.69 26.48 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.238 -0.914 . . . . 0.0 109.499 179.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 97.0 mt -106.67 3.13 26.43 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.277 -0.89 . . . . 0.0 109.501 -179.073 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 78.7 p -52.75 -36.76 58.36 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.263 -0.898 . . . . 0.0 109.408 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 54.3 p -81.17 14.45 2.34 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.273 -0.892 . . . . 0.0 109.457 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.625 ' O ' ' NZ ' ' A' ' 48' ' ' LYS . 47.0 t80 -88.75 133.15 34.33 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.255 -0.903 . . . . 0.0 109.402 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.499 ' O ' ' N ' ' A' ' 69' ' ' GLY . 64.4 t0 -82.87 114.11 20.95 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.299 -0.876 . . . . 0.0 109.48 -179.734 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 64.0 t80 -75.02 -44.89 45.4 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.249 -0.907 . . . . 0.0 109.477 -179.068 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.61 -46.09 84.52 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.314 -0.866 . . . . 0.0 109.459 -179.214 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . 0.534 ' O ' ' NH2' ' A' ' 19' ' ' ARG . 43.3 p -94.71 -13.45 25.74 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.245 -0.91 . . . . 0.0 109.486 -179.836 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . 0.507 ' HA3' ' HE ' ' A' ' 19' ' ' ARG . . . 61.72 40.23 98.5 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 179.732 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -137.75 157.21 46.92 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.267 -1.137 . . . . 0.0 109.468 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.4 ' SD ' ' HB2' ' A' ' 12' ' ' ALA . 3.0 ttt -84.6 122.97 29.8 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.197 -0.939 . . . . 0.0 109.422 -179.684 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 7.2 tt . . . . . 0 N--CA 1.49 1.572 0 O-C-N 121.334 -0.854 . . . . 0.0 109.449 -179.908 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.448 ' N ' ' OE2' ' A' ' 20' ' ' GLU . 8.3 tpm_? . . . . . 0 N--CA 1.49 1.558 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.412 ' N ' ' HG3' ' A' ' 5' ' ' ARG . 7.4 ptmt -115.98 109.81 18.08 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.196 -0.94 . . . . 0.0 109.496 179.465 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -120.88 133.61 55.3 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.22 -0.925 . . . . 0.0 109.493 -179.424 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.444 ' HB2' ' HE ' ' A' ' 19' ' ' ARG . 2.0 m0 -129.82 175.97 8.41 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.232 -0.918 . . . . 0.0 109.502 179.879 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 -75.38 143.39 42.81 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.258 -0.902 . . . . 0.0 109.417 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.2 t -101.93 108.5 56.65 Favored Pre-proline 0 N--CA 1.49 1.575 0 O-C-N 121.259 -0.901 . . . . 0.0 109.448 179.703 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -77.01 -14.99 16.69 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 C-N-CA 122.891 2.394 . . . . 0.0 112.226 -179.223 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -71.39 -40.33 70.62 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.274 -0.891 . . . . 0.0 109.402 -179.746 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.524 ' N ' HD23 ' A' ' 13' ' ' LEU . 0.3 OUTLIER -96.19 -179.59 0.95 Allowed Pre-proline 0 N--CA 1.49 1.527 0 O-C-N 121.236 -0.915 . . . . 0.0 109.433 -179.947 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . 0.517 ' CD ' ' CB ' ' A' ' 13' ' ' LEU . 33.6 Cg_exo -60.34 145.91 97.67 Favored 'Trans proline' 0 C--N 1.306 -1.701 0 C-N-CA 122.786 2.324 . . . . 0.0 112.247 -179.481 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 19.2 mm100 -51.79 128.85 24.94 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.175 -0.953 . . . . 0.0 109.524 -179.821 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 123.96 -24.17 6.41 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.626 -1.39 . . . . 0.0 109.626 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 31.0 m95 -84.16 145.91 28.13 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.28 -1.129 . . . . 0.0 109.483 179.308 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -138.42 154.93 48.89 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.228 -0.92 . . . . 0.0 109.527 -179.458 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.598 ' H ' ' CD ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -126.59 162.17 26.32 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.294 -0.879 . . . . 0.0 109.474 179.252 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.448 ' OE2' ' N ' ' A' ' 5' ' ' ARG . 78.0 tt0 -143.22 144.55 32.2 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.219 -0.925 . . . . 0.0 109.48 -179.004 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -113.07 132.68 55.32 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.192 -0.942 . . . . 0.0 109.387 179.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.5 t -127.53 108.95 20.89 Favored Pre-proline 0 N--CA 1.491 1.589 0 O-C-N 121.217 -0.927 . . . . 0.0 109.609 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -74.53 142.72 29.84 Favored 'Trans proline' 0 C--N 1.305 -1.713 0 C-N-CA 122.811 2.341 . . . . 0.0 112.127 -178.557 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 80.6 mtp85 . . . . . 0 N--CA 1.489 1.512 0 O-C-N 121.189 -0.944 . . . . 0.0 109.448 179.059 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 78.5 m80 . . . . . 0 N--CA 1.489 1.512 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 36.2 ptt-85 -112.26 132.77 54.76 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.203 -0.935 . . . . 0.0 109.56 -179.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -87.88 142.24 27.96 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.266 -0.896 . . . . 0.0 109.475 179.289 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 59.6 t -112.72 125.74 70.02 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.317 -0.865 . . . . 0.0 109.496 179.91 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 84.0 m-85 -112.98 144.28 42.83 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.238 -0.913 . . . . 0.0 109.518 179.11 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.668 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 49.9 m-85 -112.71 148.46 34.66 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.233 -0.917 . . . . 0.0 109.455 -179.786 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.569 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 3.1 m-85 -127.88 140.37 52.06 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.312 -0.867 . . . . 0.0 109.609 -179.934 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.431 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -96.21 176.64 2.07 Favored Pre-proline 0 N--CA 1.491 1.606 0 O-C-N 121.214 -0.929 . . . . 0.0 109.467 179.775 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.431 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 53.1 Cg_exo -54.29 -30.13 60.86 Favored 'Trans proline' 0 C--N 1.305 -1.728 0 C-N-CA 122.797 2.332 . . . . 0.0 112.252 179.568 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 11.7 t -88.0 -3.27 58.93 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.248 -0.908 . . . . 0.0 109.477 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 87.61 21.97 45.39 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.549 -1.421 . . . . 0.0 109.549 -179.673 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 61.6 tttp -73.57 123.76 24.59 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.306 -1.114 . . . . 0.0 109.452 -179.668 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -90.8 121.59 32.8 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.267 -0.895 . . . . 0.0 109.443 179.331 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.447 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 8.9 p90 -141.07 148.17 39.75 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.21 -0.931 . . . . 0.0 109.511 179.763 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -142.31 70.61 1.33 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.207 -0.933 . . . . 0.0 109.49 179.137 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.432 ' O ' HD23 ' A' ' 51' ' ' LEU . 1.5 p -158.67 144.44 16.68 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.296 -0.877 . . . . 0.0 109.423 179.575 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.675 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 12.9 tptt -65.46 -41.71 52.19 Favored Pre-proline 0 N--CA 1.49 1.547 0 O-C-N 121.316 -0.865 . . . . 0.0 109.455 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.675 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 39.0 Cg_exo -57.23 -40.35 83.22 Favored 'Trans proline' 0 C--N 1.306 -1.699 0 C-N-CA 122.839 2.36 . . . . 0.0 112.259 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -68.22 -39.1 82.45 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.202 -0.936 . . . . 0.0 109.46 179.747 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.432 HD23 ' O ' ' A' ' 47' ' ' SER . 4.0 mm? -61.92 -46.34 89.79 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.253 -0.904 . . . . 0.0 109.457 -179.504 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.633 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -73.9 -42.81 60.11 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.339 -0.851 . . . . 0.0 109.452 -179.361 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 75.7 ttt180 -58.59 -47.32 84.72 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.296 -0.877 . . . . 0.0 109.515 -179.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 18.4 t80 -69.8 -53.88 16.19 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.222 -0.924 . . . . 0.0 109.479 -179.454 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.438 ' O ' ' N ' ' A' ' 57' ' ' GLY . 96.0 mt -80.35 0.39 33.27 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.288 -0.883 . . . . 0.0 109.45 -179.142 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . 0.633 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -56.98 89.72 0.01 OUTLIER Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . 0.438 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . 133.18 -1.08 4.49 Favored Glycine 0 N--CA 1.491 2.346 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 -179.885 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 32.2 t -105.23 -31.02 9.3 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.27 -1.135 . . . . 0.0 109.457 179.786 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 3.1 ptp -178.71 176.75 0.94 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.33 -0.856 . . . . 0.0 109.512 -179.831 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -85.86 104.64 15.71 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.214 -0.929 . . . . 0.0 109.436 179.462 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -85.98 -0.89 56.62 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.162 -0.961 . . . . 0.0 109.453 -179.662 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 40.9 t -53.67 -37.64 63.38 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.157 -0.964 . . . . 0.0 109.442 -179.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . 0.51 ' O ' ' SD ' ' A' ' 71' ' ' MET . 37.8 p -95.23 45.68 1.1 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.207 -0.933 . . . . 0.0 109.43 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 26.3 t80 -121.26 129.86 53.37 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.259 -0.901 . . . . 0.0 109.478 -179.69 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.454 ' O ' ' N ' ' A' ' 69' ' ' GLY . 57.9 t0 -90.2 110.17 21.22 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.266 -0.897 . . . . 0.0 109.418 -179.974 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.668 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 74.6 t80 -77.19 -40.27 45.86 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.233 -0.917 . . . . 0.0 109.445 -179.915 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 26.6 mmt180 -61.07 -39.31 89.4 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.23 -0.919 . . . . 0.0 109.53 -179.609 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . 0.443 ' OG1' ' CG ' ' A' ' 65' ' ' ASP . 34.6 p -100.35 -15.45 17.98 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.27 -0.894 . . . . 0.0 109.516 -179.528 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . 0.454 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 64.21 42.64 97.84 Favored Glycine 0 N--CA 1.491 2.336 0 N-CA-C 109.542 -1.423 . . . . 0.0 109.542 179.661 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.5 tppt? -135.9 143.46 45.01 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.24 -1.153 . . . . 0.0 109.468 179.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.51 ' SD ' ' O ' ' A' ' 63' ' ' THR . 35.8 tpp -85.23 131.72 34.38 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.244 -0.91 . . . . 0.0 109.5 -179.616 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.566 ' C ' HD23 ' A' ' 72' ' ' LEU . 4.4 tt . . . . . 0 N--CA 1.491 1.588 0 O-C-N 121.177 -0.952 . . . . 0.0 109.442 -179.761 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 62.9 ttp180 . . . . . 0 N--CA 1.49 1.538 0 CA-C-O 121.324 0.583 . . . . 0.0 109.43 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 56.7 mttt -74.12 163.27 28.07 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.202 -0.936 . . . . 0.0 109.481 179.882 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.589 ' O ' ' CD1' ' A' ' 8' ' ' TRP . 15.0 mmt180 -142.38 134.03 26.78 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.248 -0.907 . . . . 0.0 109.499 -178.617 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.589 ' CD1' ' O ' ' A' ' 7' ' ' ARG . 5.8 m0 -159.62 132.81 6.95 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.147 -0.97 . . . . 0.0 109.477 179.831 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -73.62 148.55 42.76 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.251 -0.906 . . . . 0.0 109.465 179.286 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.433 ' SG ' HD13 ' A' ' 13' ' ' LEU . 34.1 t -112.69 100.99 52.11 Favored Pre-proline 0 N--CA 1.488 1.448 0 O-C-N 121.236 -0.915 . . . . 0.0 109.523 -179.585 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_exo -54.2 -29.14 55.18 Favored 'Trans proline' 0 C--N 1.306 -1.705 0 C-N-CA 122.885 2.39 . . . . 0.0 112.204 179.092 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.591 ' HB2' ' HG3' ' A' ' 71' ' ' MET . . . -66.25 -24.53 66.6 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.334 -0.854 . . . . 0.0 109.502 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.571 ' CD1' ' N ' ' A' ' 13' ' ' LEU . 4.8 mp -96.1 155.84 37.76 Favored Pre-proline 0 N--CA 1.489 1.519 0 O-C-N 121.263 -0.898 . . . . 0.0 109.542 -179.841 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . 0.675 ' HG3' HD11 ' A' ' 55' ' ' LEU . 37.7 Cg_exo -59.34 143.8 99.61 Favored 'Trans proline' 0 C--N 1.305 -1.719 0 C-N-CA 122.799 2.333 . . . . 0.0 112.182 179.273 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 70.5 tp60 -47.81 129.44 14.2 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.278 -0.889 . . . . 0.0 109.491 179.601 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 119.24 -21.9 9.16 Favored Glycine 0 N--CA 1.489 2.214 0 N-CA-C 109.576 -1.409 . . . . 0.0 109.576 -179.317 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . 0.41 ' N ' ' CD1' ' A' ' 17' ' ' TRP . 15.9 m95 -83.73 151.35 25.28 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.219 -1.165 . . . . 0.0 109.456 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -128.94 146.05 51.06 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.239 -0.913 . . . . 0.0 109.472 -179.394 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.533 ' NH2' HG11 ' A' ' 35' ' ' VAL . 77.8 ttt-85 -127.86 123.87 36.12 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.242 -0.911 . . . . 0.0 109.478 178.853 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.543 ' OE1' ' CZ ' ' A' ' 7' ' ' ARG . 7.2 pt-20 -131.37 138.92 49.35 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.254 -0.903 . . . . 0.0 109.529 -179.834 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 46.0 tt0 -94.39 143.95 25.97 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.333 -0.854 . . . . 0.0 109.423 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.411 HG13 ' HD2' ' A' ' 23' ' ' PRO . 47.3 t -126.5 135.56 27.41 Favored Pre-proline 0 N--CA 1.49 1.552 0 O-C-N 121.206 -0.933 . . . . 0.0 109.606 -179.257 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . 0.411 ' HD2' HG13 ' A' ' 22' ' ' VAL . 34.9 Cg_endo -65.58 152.21 82.47 Favored 'Trans proline' 0 C--N 1.304 -1.772 0 C-N-CA 122.828 2.352 . . . . 0.0 112.214 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.511 ' CZ ' ' O ' ' A' ' 24' ' ' ARG . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.589 0 O-C-N 121.258 -0.901 . . . . 0.0 109.504 -178.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 74.0 m80 . . . . . 0 N--CA 1.49 1.552 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 84.8 mtt85 -111.62 128.05 55.93 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.228 -0.92 . . . . 0.0 109.461 179.818 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 97.1 m-20 -91.37 140.28 29.92 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.135 -0.978 . . . . 0.0 109.461 -179.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.533 HG11 ' NH2' ' A' ' 19' ' ' ARG . 21.5 t -106.08 132.85 52.13 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.272 -0.893 . . . . 0.0 109.436 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.526 ' CD1' ' NZ ' ' A' ' 44' ' ' LYS . 78.4 m-85 -120.96 142.23 49.94 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.299 -0.876 . . . . 0.0 109.444 179.634 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -112.31 146.36 38.39 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.299 -0.876 . . . . 0.0 109.536 -179.642 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 87.7 m-85 -126.49 139.98 52.81 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.176 -0.953 . . . . 0.0 109.529 179.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.412 ' CB ' ' HD2' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -100.44 165.18 14.87 Favored Pre-proline 0 N--CA 1.489 1.502 0 O-C-N 121.223 -0.923 . . . . 0.0 109.418 179.644 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.412 ' HD2' ' CB ' ' A' ' 39' ' ' SER . 18.8 Cg_endo -58.81 -19.37 46.43 Favored 'Trans proline' 0 C--N 1.306 -1.685 0 C-N-CA 122.783 2.322 . . . . 0.0 112.258 179.705 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 3.0 p -89.98 -0.91 57.84 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.291 -0.88 . . . . 0.0 109.433 179.725 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 86.61 14.65 65.17 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.506 -1.438 . . . . 0.0 109.506 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -80.35 117.42 21.09 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.296 -1.12 . . . . 0.0 109.511 -179.633 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.526 ' NZ ' ' CD1' ' A' ' 36' ' ' PHE . 61.5 tttm -92.57 128.86 38.58 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.297 -0.877 . . . . 0.0 109.396 178.765 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.624 ' N ' ' CD1' ' A' ' 45' ' ' PHE . 1.0 OUTLIER -139.71 147.25 40.66 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.222 -0.924 . . . . 0.0 109.457 -179.716 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.623 ' O ' ' NE ' ' A' ' 46' ' ' ARG . 0.6 OUTLIER -137.36 62.12 1.6 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.161 -0.962 . . . . 0.0 109.53 179.635 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -150.14 133.34 16.31 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.306 -0.871 . . . . 0.0 109.433 179.871 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.599 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 1.1 tmtp? -55.42 -46.79 99.65 Favored Pre-proline 0 N--CA 1.491 1.59 0 O-C-N 121.238 -0.913 . . . . 0.0 109.437 -179.599 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.599 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 51.8 Cg_exo -53.7 -35.28 77.56 Favored 'Trans proline' 0 C--N 1.306 -1.685 0 C-N-CA 122.813 2.342 . . . . 0.0 112.234 -179.799 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.581 ' OE1' ' NH2' ' A' ' 53' ' ' ARG . 3.6 mm100 -67.09 -36.85 82.86 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.246 -0.909 . . . . 0.0 109.554 179.821 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.475 ' CD2' ' N ' ' A' ' 51' ' ' LEU . 3.8 mm? -66.4 -53.9 30.56 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.153 -0.967 . . . . 0.0 109.457 -179.046 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.617 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -66.97 -47.7 70.77 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.331 -0.855 . . . . 0.0 109.511 -178.521 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.581 ' NH2' ' OE1' ' A' ' 50' ' ' GLN . 57.3 ttp180 -59.21 -45.06 92.11 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.278 -0.889 . . . . 0.0 109.463 -178.839 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -69.7 -54.48 13.6 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.334 -0.854 . . . . 0.0 109.468 -179.211 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.675 HD11 ' HG3' ' A' ' 14' ' ' PRO . 1.8 mm? -80.42 -0.58 37.74 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.271 -0.893 . . . . 0.0 109.487 -179.462 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . 0.919 ' O ' ' N ' ' A' ' 58' ' ' SER . . . -51.39 -176.13 0.03 OUTLIER Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.514 -1.434 . . . . 0.0 109.514 179.641 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 43.9 -69.81 0.0 OUTLIER Glycine 0 N--CA 1.491 2.337 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.919 ' N ' ' O ' ' A' ' 56' ' ' GLY . 82.8 p -57.72 -30.89 65.91 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.29 -1.123 . . . . 0.0 109.441 -178.244 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.443 ' O ' ' O ' ' A' ' 55' ' ' LEU . 1.3 mmm -167.29 160.19 13.33 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.209 -0.932 . . . . 0.0 109.493 -179.419 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 45.2 t0 -109.59 129.08 55.61 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.201 -0.937 . . . . 0.0 109.441 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 94.4 mt -114.65 16.12 17.55 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.193 -0.942 . . . . 0.0 109.427 -179.173 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 12.0 t -58.03 -38.04 75.48 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.257 -0.902 . . . . 0.0 109.462 179.825 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 17.9 p -87.9 19.62 3.46 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.266 -0.896 . . . . 0.0 109.5 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 60.0 t80 -88.52 132.38 34.53 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.213 -0.929 . . . . 0.0 109.458 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.51 ' HB2' HD23 ' A' ' 72' ' ' LEU . 60.1 t0 -83.43 111.51 19.1 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.356 -0.84 . . . . 0.0 109.454 -179.39 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 15.6 t80 -76.63 -39.93 50.85 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.256 -0.903 . . . . 0.0 109.517 -179.792 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.548 ' NE ' ' H ' ' A' ' 67' ' ' ARG . 0.2 OUTLIER -63.83 -42.29 97.65 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.182 -0.949 . . . . 0.0 109.575 -179.16 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . 0.447 ' OG1' ' OD2' ' A' ' 65' ' ' ASP . 27.5 p -98.43 -12.47 21.34 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.317 -0.864 . . . . 0.0 109.591 -179.359 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . 0.445 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 63.21 39.87 98.41 Favored Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.526 -1.43 . . . . 0.0 109.526 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.479 ' H ' ' HB3' ' A' ' 65' ' ' ASP . 68.6 mttm -140.3 157.76 45.07 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.154 -1.204 . . . . 0.0 109.453 -179.523 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.591 ' HG3' ' HB2' ' A' ' 12' ' ' ALA . 68.4 mtp -86.02 132.21 34.1 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.257 -0.902 . . . . 0.0 109.556 179.805 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.51 HD23 ' HB2' ' A' ' 65' ' ' ASP . 4.0 mm? . . . . . 0 N--CA 1.491 1.612 0 O-C-N 121.301 -0.874 . . . . 0.0 109.472 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.6 mtt85 . . . . . 0 N--CA 1.49 1.571 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.425 ' HB2' ' CZ2' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -121.84 113.64 19.93 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.318 -0.863 . . . . 0.0 109.441 -179.86 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.492 ' CD ' ' C ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -102.86 123.17 46.0 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.22 -0.925 . . . . 0.0 109.462 179.849 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.425 ' CZ2' ' HB2' ' A' ' 6' ' ' LYS . 7.7 m0 -125.76 175.21 7.78 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.284 -0.885 . . . . 0.0 109.458 179.844 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 31.2 tp10 -81.15 155.12 26.37 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.271 -0.893 . . . . 0.0 109.526 179.686 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.554 ' SG ' ' N ' ' A' ' 19' ' ' ARG . 3.4 m -114.3 100.51 52.95 Favored Pre-proline 0 N--CA 1.49 1.562 0 O-C-N 121.29 -0.881 . . . . 0.0 109.395 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -53.64 -38.04 84.01 Favored 'Trans proline' 0 C--N 1.305 -1.727 0 C-N-CA 122.879 2.386 . . . . 0.0 112.255 179.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.0 -39.5 78.43 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.225 -0.922 . . . . 0.0 109.529 -179.522 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.574 ' CD2' ' N ' ' A' ' 13' ' ' LEU . 2.5 mm? -91.63 155.78 43.53 Favored Pre-proline 0 N--CA 1.489 1.499 0 O-C-N 121.2 -0.937 . . . . 0.0 109.546 179.896 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -55.59 160.27 9.62 Favored 'Trans proline' 0 C--N 1.303 -1.819 0 C-N-CA 122.905 2.403 . . . . 0.0 112.228 -179.591 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 59.3 tt0 -54.63 125.32 19.34 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.206 -0.934 . . . . 0.0 109.466 -179.166 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 125.23 -20.99 6.54 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.601 -1.4 . . . . 0.0 109.601 179.259 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . 0.401 ' CG ' ' HB3' ' A' ' 13' ' ' LEU . 34.9 m95 -89.59 140.9 29.09 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.196 -1.179 . . . . 0.0 109.488 178.875 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.577 ' OE1' ' N ' ' A' ' 18' ' ' GLU . 54.5 mp0 -135.8 152.8 51.46 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.269 -0.895 . . . . 0.0 109.508 -179.09 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.554 ' N ' ' SG ' ' A' ' 10' ' ' CYS . 4.8 ptm85 -118.52 161.24 20.35 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.269 -0.894 . . . . 0.0 109.428 178.82 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.564 ' O ' HG13 ' A' ' 35' ' ' VAL . 79.1 tt0 -143.05 137.43 29.22 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.208 -0.932 . . . . 0.0 109.5 -179.351 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.427 ' HG2' HG22 ' A' ' 35' ' ' VAL . 99.2 mt-10 -110.91 131.0 55.42 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.241 -0.912 . . . . 0.0 109.334 -179.803 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.9 t -136.1 123.27 14.5 Favored Pre-proline 0 N--CA 1.49 1.528 0 O-C-N 121.165 -0.959 . . . . 0.0 109.549 -179.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -75.76 135.51 17.8 Favored 'Trans proline' 0 C--N 1.304 -1.791 0 C-N-CA 122.816 2.344 . . . . 0.0 112.209 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 35.8 ttm180 . . . . . 0 N--CA 1.491 1.585 0 O-C-N 121.237 -0.914 . . . . 0.0 109.429 179.962 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 19.1 m170 . . . . . 0 N--CA 1.49 1.562 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 62.4 ttp180 -114.14 126.19 54.8 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.28 -0.888 . . . . 0.0 109.419 -179.642 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.505 ' O ' ' OD1' ' A' ' 34' ' ' ASP . 3.5 p30 -107.25 141.46 38.52 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.224 -0.923 . . . . 0.0 109.403 -179.827 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.564 HG13 ' O ' ' A' ' 20' ' ' GLU . 35.1 t -114.89 131.91 65.68 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.143 -0.973 . . . . 0.0 109.426 -179.817 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -106.57 148.32 28.4 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.287 -0.883 . . . . 0.0 109.409 179.497 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.574 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 63.4 m-85 -116.1 147.18 41.58 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.302 -0.874 . . . . 0.0 109.439 -179.396 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -129.39 143.03 50.68 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.228 -0.92 . . . . 0.0 109.491 -179.446 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.429 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -97.88 176.57 1.98 Allowed Pre-proline 0 N--CA 1.491 1.575 0 O-C-N 121.347 -0.846 . . . . 0.0 109.428 179.784 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.429 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 48.6 Cg_exo -54.46 -28.53 54.83 Favored 'Trans proline' 0 C--N 1.305 -1.74 0 C-N-CA 122.888 2.392 . . . . 0.0 112.227 179.632 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 95.0 p -89.67 0.68 56.8 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.241 -0.912 . . . . 0.0 109.475 179.781 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 83.91 17.75 64.77 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 -179.681 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 61.0 tttp -70.5 122.58 19.95 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.25 -1.147 . . . . 0.0 109.479 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 63.7 tttm -92.39 125.83 37.22 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.222 -0.924 . . . . 0.0 109.531 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.591 ' HE2' HD21 ' A' ' 51' ' ' LEU . 3.3 p90 -140.32 146.99 39.2 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.225 -0.922 . . . . 0.0 109.466 -179.693 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 46' ' ' ARG . 6.3 ptm85 -139.31 59.28 1.61 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.359 -0.838 . . . . 0.0 109.433 179.138 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.3 m -152.38 131.84 12.96 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.188 -0.945 . . . . 0.0 109.52 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.614 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 3.2 tmtp? -61.2 -45.39 95.54 Favored Pre-proline 0 N--CA 1.489 1.505 0 O-C-N 121.221 -0.924 . . . . 0.0 109.413 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.614 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 42.7 Cg_exo -55.69 -43.39 58.04 Favored 'Trans proline' 0 C--N 1.305 -1.747 0 C-N-CA 122.807 2.338 . . . . 0.0 112.224 179.58 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -65.02 -36.46 84.46 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.229 -0.919 . . . . 0.0 109.542 179.408 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.591 HD21 ' HE2' ' A' ' 45' ' ' PHE . 15.1 mt -62.11 -44.29 96.97 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.32 -0.863 . . . . 0.0 109.491 -179.829 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.708 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -77.2 -46.61 22.71 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.223 -0.923 . . . . 0.0 109.502 -179.865 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 14.1 tpp180 -54.15 -26.57 28.42 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.152 -0.967 . . . . 0.0 109.505 -179.519 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 68.1 t80 -97.59 -53.39 3.45 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.295 -0.878 . . . . 0.0 109.519 -179.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.424 ' C ' ' H ' ' A' ' 57' ' ' GLY . 3.4 tp -106.93 -4.6 18.94 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.197 -0.939 . . . . 0.0 109.497 -178.005 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . 0.708 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -61.61 -2.38 3.32 Favored Glycine 0 N--CA 1.489 2.213 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 -179.789 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . 0.424 ' H ' ' C ' ' A' ' 55' ' ' LEU . . . -99.17 -52.18 1.27 Allowed Glycine 0 N--CA 1.491 2.318 0 N-CA-C 109.526 -1.429 . . . . 0.0 109.526 -179.842 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 9.3 m -77.86 -10.43 59.56 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.265 -1.138 . . . . 0.0 109.524 179.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 52.1 ttm -159.19 152.07 21.94 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.222 -0.924 . . . . 0.0 109.483 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.477 ' OD1' ' OG ' ' A' ' 62' ' ' SER . 59.6 t0 -91.27 110.82 22.12 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.253 -0.904 . . . . 0.0 109.476 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.567 ' N ' HD22 ' A' ' 61' ' ' LEU . 3.8 mm? -93.72 -1.07 55.62 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.334 -0.854 . . . . 0.0 109.445 -179.929 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.477 ' OG ' ' OD1' ' A' ' 60' ' ' ASP . 94.1 p -57.63 -37.47 73.37 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.265 -0.897 . . . . 0.0 109.55 179.609 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 48.3 p -91.75 10.15 29.59 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.196 -0.94 . . . . 0.0 109.549 -179.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -87.51 132.7 33.94 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.204 -0.935 . . . . 0.0 109.487 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.478 ' CG ' ' OG1' ' A' ' 68' ' ' THR . 55.3 t0 -85.49 110.81 19.45 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.298 -0.876 . . . . 0.0 109.543 -179.835 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.574 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 81.7 t80 -77.2 -41.32 41.85 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.269 -0.895 . . . . 0.0 109.482 -179.402 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 16.5 tpp180 -63.19 -42.53 99.35 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.265 -0.897 . . . . 0.0 109.501 -179.177 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . 0.478 ' OG1' ' CG ' ' A' ' 65' ' ' ASP . 25.5 p -96.22 -13.4 23.48 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.297 -0.877 . . . . 0.0 109.473 -179.529 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . 0.409 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 62.54 41.87 99.75 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.415 -1.474 . . . . 0.0 109.415 179.731 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.436 ' H ' ' HB3' ' A' ' 65' ' ' ASP . 98.5 mttt -134.54 147.87 50.39 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.222 -1.164 . . . . 0.0 109.43 -179.717 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 34.2 ttm -89.86 125.17 35.23 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.217 -0.927 . . . . 0.0 109.561 -179.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 2.3 pp . . . . . 0 N--CA 1.489 1.52 0 O-C-N 121.223 -0.923 . . . . 0.0 109.519 179.833 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.443 ' HB3' HG22 ' A' ' 22' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.533 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.621 ' NZ ' ' O ' ' A' ' 21' ' ' GLU . 0.3 OUTLIER -115.61 110.39 19.13 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.207 -0.933 . . . . 0.0 109.493 179.864 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 86.3 mtm180 -93.5 112.37 24.26 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.365 -0.834 . . . . 0.0 109.483 -179.819 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 11.9 m0 -105.26 160.16 15.32 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.267 -0.896 . . . . 0.0 109.376 179.355 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -77.2 139.4 39.88 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.179 -0.95 . . . . 0.0 109.455 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.541 ' SG ' HD23 ' A' ' 13' ' ' LEU . 2.4 t -106.12 102.49 40.09 Favored Pre-proline 0 N--CA 1.49 1.528 0 O-C-N 121.269 -0.894 . . . . 0.0 109.548 179.309 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -72.48 -13.26 27.6 Favored 'Trans proline' 0 C--N 1.304 -1.764 0 C-N-CA 122.838 2.359 . . . . 0.0 112.265 -178.521 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.572 ' C ' HD22 ' A' ' 13' ' ' LEU . . . -82.65 -20.11 36.91 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.181 -0.949 . . . . 0.0 109.494 -179.682 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.673 HD22 ' N ' ' A' ' 13' ' ' LEU . 3.8 mm? -101.13 157.93 32.74 Favored Pre-proline 0 N--CA 1.49 1.55 0 O-C-N 121.222 -0.924 . . . . 0.0 109.465 -179.873 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -52.69 144.67 41.99 Favored 'Trans proline' 0 C--N 1.305 -1.742 0 C-N-CA 122.804 2.336 . . . . 0.0 112.188 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -47.19 123.33 5.33 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.281 -0.887 . . . . 0.0 109.445 -179.524 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 124.02 -21.77 6.9 Favored Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.647 -1.381 . . . . 0.0 109.647 179.67 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . 0.406 ' CZ3' ' CZ ' ' A' ' 45' ' ' PHE . 21.3 m95 -85.42 146.68 26.86 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.225 -1.162 . . . . 0.0 109.439 179.505 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -132.13 149.32 52.43 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.194 -0.941 . . . . 0.0 109.451 -179.554 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.547 ' HE ' HG11 ' A' ' 35' ' ' VAL . 77.7 ttt-85 -114.92 157.44 23.36 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.188 -0.945 . . . . 0.0 109.497 179.416 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.673 ' OE1' HG23 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -152.5 153.68 33.97 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.248 -0.908 . . . . 0.0 109.494 -179.092 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.621 ' O ' ' NZ ' ' A' ' 6' ' ' LYS . 79.2 tt0 -119.5 131.28 55.54 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.331 -0.856 . . . . 0.0 109.338 179.318 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.673 HG23 ' OE1' ' A' ' 20' ' ' GLU . 7.6 t -130.28 125.35 21.75 Favored Pre-proline 0 N--CA 1.489 1.517 0 O-C-N 121.218 -0.926 . . . . 0.0 109.6 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -73.76 122.63 7.91 Favored 'Trans proline' 0 C--N 1.304 -1.81 0 C-N-CA 122.804 2.336 . . . . 0.0 112.156 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.595 0 O-C-N 121.199 -0.938 . . . . 0.0 109.473 -179.716 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 13.4 m170 . . . . . 0 N--CA 1.49 1.566 0 N-CA-C 109.406 -0.591 . . . . 0.0 109.406 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 38.2 mmm-85 -112.27 109.07 18.52 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.254 -0.904 . . . . 0.0 109.508 -179.395 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -94.22 141.13 28.91 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.193 -0.942 . . . . 0.0 109.39 179.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.547 HG11 ' HE ' ' A' ' 19' ' ' ARG . 49.0 t -107.32 132.11 55.65 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.282 -0.887 . . . . 0.0 109.4 -179.152 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 -122.4 145.88 47.86 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.208 -0.933 . . . . 0.0 109.469 178.598 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.672 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 63.6 m-85 -119.02 151.52 38.07 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.311 -0.868 . . . . 0.0 109.382 -179.275 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 47.3 m-85 -123.7 139.9 53.53 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.187 -0.946 . . . . 0.0 109.518 179.638 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.451 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -95.37 177.28 1.85 Allowed Pre-proline 0 N--CA 1.49 1.561 0 O-C-N 121.33 -0.856 . . . . 0.0 109.539 179.178 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.451 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 48.3 Cg_exo -54.33 -29.21 56.9 Favored 'Trans proline' 0 C--N 1.304 -1.763 0 C-N-CA 122.838 2.359 . . . . 0.0 112.116 179.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 20.9 t -90.46 -1.55 57.9 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.251 -0.906 . . . . 0.0 109.499 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 86.46 22.51 47.12 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 75.5 tttt -75.42 127.17 32.52 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.193 -1.181 . . . . 0.0 109.453 -179.721 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.443 ' O ' ' HG3' ' A' ' 44' ' ' LYS . 21.3 ptmt -93.0 124.79 37.22 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.247 -0.908 . . . . 0.0 109.477 179.382 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.592 ' CE2' HD11 ' A' ' 51' ' ' LEU . 3.6 p90 -141.87 150.53 41.69 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.207 -0.933 . . . . 0.0 109.439 179.803 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.553 ' CD ' ' N ' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -135.66 67.02 1.49 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.262 -0.899 . . . . 0.0 109.472 179.708 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.3 m -157.15 116.87 3.43 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.304 -0.873 . . . . 0.0 109.403 179.551 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.584 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -53.78 -46.84 98.25 Favored Pre-proline 0 N--CA 1.489 1.52 0 O-C-N 121.256 -0.902 . . . . 0.0 109.542 -178.933 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.584 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 52.2 Cg_exo -54.35 -39.13 88.51 Favored 'Trans proline' 0 C--N 1.305 -1.717 0 C-N-CA 122.805 2.336 . . . . 0.0 112.202 179.433 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -61.54 -36.3 80.19 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.297 -0.877 . . . . 0.0 109.448 179.369 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.592 HD11 ' CE2' ' A' ' 45' ' ' PHE . 11.2 mp -66.46 -42.58 87.35 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.255 -0.903 . . . . 0.0 109.437 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -66.89 -50.41 62.54 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.174 -0.954 . . . . 0.0 109.471 -179.563 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.463 HH12 ' HB3' ' A' ' 49' ' ' PRO . 96.1 mtm-85 -60.18 -44.88 94.71 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.209 -0.932 . . . . 0.0 109.542 -179.378 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 67.8 t80 -65.81 -55.21 18.31 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.201 -0.937 . . . . 0.0 109.466 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 96.5 mt -61.45 -42.01 98.1 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.21 -0.931 . . . . 0.0 109.504 -179.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 93.94 -146.53 18.18 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 109.561 -1.416 . . . . 0.0 109.561 179.689 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -98.16 27.38 19.54 Favored Glycine 0 N--CA 1.492 2.381 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 179.761 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 13.0 m -89.42 -25.8 21.33 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.261 -1.141 . . . . 0.0 109.485 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 97.5 mtp -143.45 134.29 25.33 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.273 -0.892 . . . . 0.0 109.412 179.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -97.94 116.39 30.05 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.284 -0.885 . . . . 0.0 109.461 179.274 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.433 HD23 ' HA ' ' A' ' 61' ' ' LEU . 97.1 mt -95.82 2.75 53.95 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.119 -0.988 . . . . 0.0 109.469 -179.556 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 69.0 m -50.76 -39.01 51.2 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.255 -0.903 . . . . 0.0 109.506 179.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 31.4 p -94.6 39.67 1.09 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.254 -0.904 . . . . 0.0 109.52 179.229 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 85.0 t80 -125.75 125.67 43.35 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.257 -0.902 . . . . 0.0 109.437 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.603 ' O ' ' N ' ' A' ' 69' ' ' GLY . 89.3 m-20 -76.71 107.66 9.18 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.168 -0.958 . . . . 0.0 109.524 -179.609 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.672 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 54.5 t80 -74.78 -48.88 23.05 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.174 -0.953 . . . . 0.0 109.51 -179.821 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 18.3 mmm180 -54.72 -42.26 71.32 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.276 -0.89 . . . . 0.0 109.564 179.666 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 6.7 p -98.09 -14.35 20.51 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.169 -0.957 . . . . 0.0 109.462 -179.748 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . 0.603 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 64.77 31.68 81.7 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 179.728 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.417 ' H ' ' HB2' ' A' ' 65' ' ' ASP . 72.0 mmtt -112.57 150.66 31.03 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.227 -1.16 . . . . 0.0 109.436 -179.803 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 11.9 tpp -93.86 123.97 37.56 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.197 -0.939 . . . . 0.0 109.484 179.848 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.484 HD13 ' C ' ' A' ' 72' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.573 0 O-C-N 121.135 -0.978 . . . . 0.0 109.458 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 31.0 ptt180 . . . . . 0 N--CA 1.49 1.537 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.426 ' HB2' ' H ' ' A' ' 21' ' ' GLU . 2.5 mmtp -63.06 147.8 49.68 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.352 -0.843 . . . . 0.0 109.501 -179.291 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 73.6 ttp85 -149.97 138.93 21.02 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.234 -0.916 . . . . 0.0 109.472 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.57 ' N ' ' CD1' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -167.33 142.2 3.9 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.22 -0.925 . . . . 0.0 109.463 -179.828 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -103.64 142.45 34.3 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.241 -0.912 . . . . 0.0 109.458 178.517 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.818 ' SG ' HD13 ' A' ' 13' ' ' LEU . 0.8 OUTLIER -115.19 129.15 25.32 Favored Pre-proline 0 N--CA 1.49 1.568 0 O-C-N 121.311 -0.868 . . . . 0.0 109.461 -179.657 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -51.16 -24.26 14.59 Favored 'Trans proline' 0 C--N 1.305 -1.715 0 C-N-CA 122.901 2.401 . . . . 0.0 112.233 178.499 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.466 ' O ' ' SD ' ' A' ' 59' ' ' MET . . . -71.08 -16.44 62.58 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.196 -0.94 . . . . 0.0 109.496 -179.602 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.818 HD13 ' SG ' ' A' ' 10' ' ' CYS . 5.5 mp -102.01 148.95 36.08 Favored Pre-proline 0 N--CA 1.49 1.565 0 O-C-N 121.192 -0.943 . . . . 0.0 109.402 -179.894 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . 0.465 ' HG2' ' CD1' ' A' ' 17' ' ' TRP . 37.3 Cg_endo -67.5 149.0 79.9 Favored 'Trans proline' 0 C--N 1.305 -1.726 0 C-N-CA 122.904 2.403 . . . . 0.0 112.17 179.876 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.618 ' NE2' ' O ' ' A' ' 15' ' ' GLN . 1.5 pm0 -54.44 125.98 21.65 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.294 -0.878 . . . . 0.0 109.506 -179.131 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 122.38 -29.12 5.58 Favored Glycine 0 N--CA 1.491 2.337 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 179.351 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . 0.603 ' CZ2' ' OG ' ' A' ' 39' ' ' SER . 17.0 m95 -89.23 155.42 19.41 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.213 -1.169 . . . . 0.0 109.452 179.363 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -149.63 164.54 34.89 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.142 -0.974 . . . . 0.0 109.429 -178.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.602 ' NH1' ' O ' ' A' ' 69' ' ' GLY . 13.0 mtm105 -132.69 131.99 41.89 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.245 -0.909 . . . . 0.0 109.476 178.772 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -136.48 141.54 43.49 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.175 -0.953 . . . . 0.0 109.562 -178.771 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.537 ' OE2' ' CZ ' ' A' ' 33' ' ' ARG . 80.4 tt0 -102.43 147.01 27.25 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.315 -0.866 . . . . 0.0 109.358 179.022 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.5 t -149.31 127.59 5.9 Favored Pre-proline 0 N--CA 1.49 1.535 0 O-C-N 121.184 -0.948 . . . . 0.0 109.65 -178.603 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -77.33 140.07 19.16 Favored 'Trans proline' 0 C--N 1.306 -1.707 0 C-N-CA 122.851 2.367 . . . . 0.0 112.167 178.629 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.573 ' NE ' ' OD1' ' A' ' 34' ' ' ASP . 99.2 mtt180 . . . . . 0 N--CA 1.49 1.527 0 O-C-N 121.186 -0.947 . . . . 0.0 109.534 179.526 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 . . . . . 0 N--CA 1.491 1.609 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.537 ' CZ ' ' OE2' ' A' ' 21' ' ' GLU . 83.7 mtp180 -120.25 136.72 54.56 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.256 -0.903 . . . . 0.0 109.415 -179.721 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.573 ' OD1' ' NE ' ' A' ' 24' ' ' ARG . 4.6 m-20 -122.74 143.5 49.78 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.239 -0.913 . . . . 0.0 109.419 -179.709 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 65.5 t -105.9 136.1 41.55 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 O-C-N 121.244 -0.91 . . . . 0.0 109.442 179.816 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -122.27 147.08 46.66 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.358 -0.838 . . . . 0.0 109.51 179.857 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.453 ' CB ' ' CE2' ' A' ' 45' ' ' PHE . 8.5 m-85 -112.71 139.32 48.42 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.251 -0.906 . . . . 0.0 109.455 -179.878 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 74.7 m-85 -114.33 128.44 56.35 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.221 -0.924 . . . . 0.0 109.575 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.603 ' OG ' ' CZ2' ' A' ' 17' ' ' TRP . 0.1 OUTLIER -97.61 177.28 1.69 Allowed Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.279 -0.888 . . . . 0.0 109.447 179.251 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.444 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 52.8 Cg_exo -53.76 -30.39 56.57 Favored 'Trans proline' 0 C--N 1.306 -1.677 0 C-N-CA 122.904 2.402 . . . . 0.0 112.24 179.402 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 96.4 p -87.52 4.97 41.42 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.317 -0.864 . . . . 0.0 109.461 179.56 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 74.9 12.86 82.94 Favored Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 179.755 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 5.4 ttmt -73.32 131.27 41.72 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.24 -1.153 . . . . 0.0 109.452 -179.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 16.9 pttp -94.7 130.05 41.36 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.247 -0.908 . . . . 0.0 109.447 179.195 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.668 ' N ' ' CD1' ' A' ' 45' ' ' PHE . 0.7 OUTLIER -139.53 146.3 39.74 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.271 -0.893 . . . . 0.0 109.399 -179.918 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 46.0 ptt85 -139.88 53.07 1.68 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.367 -0.833 . . . . 0.0 109.506 -179.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.4 p -150.93 134.99 16.73 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.281 -0.887 . . . . 0.0 109.464 179.573 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.607 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 0.9 OUTLIER -58.42 -46.13 99.64 Favored Pre-proline 0 N--CA 1.49 1.563 0 O-C-N 121.216 -0.927 . . . . 0.0 109.461 179.887 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.607 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 52.2 Cg_exo -53.16 -43.23 58.92 Favored 'Trans proline' 0 C--N 1.305 -1.717 0 C-N-CA 122.836 2.357 . . . . 0.0 112.189 -179.655 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -68.19 -33.94 75.36 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.248 -0.907 . . . . 0.0 109.522 179.096 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.635 ' O ' HD13 ' A' ' 51' ' ' LEU . 0.3 OUTLIER -59.37 -49.68 76.88 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.246 -0.909 . . . . 0.0 109.488 179.65 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -71.77 -37.6 70.45 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.183 -0.948 . . . . 0.0 109.55 -179.566 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 42.3 ttm180 -56.22 -51.08 69.4 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.247 -0.908 . . . . 0.0 109.558 -179.336 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . 0.441 ' C ' ' H ' ' A' ' 56' ' ' GLY . 18.4 t80 -68.51 -50.03 55.17 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.368 -0.833 . . . . 0.0 109.503 -179.708 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.436 ' O ' ' OG ' ' A' ' 58' ' ' SER . 4.2 mm? -64.23 1.2 0.78 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.144 -0.972 . . . . 0.0 109.444 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . 0.548 ' O ' ' C ' ' A' ' 57' ' ' GLY . . . 51.91 64.0 4.31 Favored Glycine 0 N--CA 1.492 2.384 0 N-CA-C 109.46 -1.456 . . . . 0.0 109.46 179.794 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . 0.548 ' C ' ' O ' ' A' ' 56' ' ' GLY . . . 33.82 36.0 0.05 OUTLIER Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.556 -1.417 . . . . 0.0 109.556 -179.515 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.53 ' N ' ' O ' ' A' ' 56' ' ' GLY . 74.2 m -85.24 -0.58 55.1 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.21 -1.171 . . . . 0.0 109.486 179.746 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.466 ' SD ' ' O ' ' A' ' 12' ' ' ALA . 40.6 ttp -157.34 149.69 22.86 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.351 -0.843 . . . . 0.0 109.497 -179.869 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 91.1 m-20 -86.34 106.35 17.33 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.292 -0.88 . . . . 0.0 109.405 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.6 ' N ' HD22 ' A' ' 61' ' ' LEU . 3.7 mm? -89.61 -4.89 57.62 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.222 -0.924 . . . . 0.0 109.462 -179.933 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 37.9 m -58.49 -33.89 70.3 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.297 -0.877 . . . . 0.0 109.532 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 17.9 p -96.45 9.22 42.01 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.178 -0.951 . . . . 0.0 109.48 -179.82 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 89.7 t80 -90.24 135.12 33.87 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.225 -0.922 . . . . 0.0 109.419 179.807 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.515 ' O ' ' N ' ' A' ' 69' ' ' GLY . 9.8 m-20 -85.67 111.29 19.95 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.248 -0.908 . . . . 0.0 109.582 179.818 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 77.4 t80 -75.16 -47.64 27.45 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.211 -0.931 . . . . 0.0 109.392 -179.286 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.45 ' HA ' ' HE ' ' A' ' 67' ' ' ARG . 0.3 OUTLIER -56.4 -43.84 79.7 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.251 -0.906 . . . . 0.0 109.474 -179.351 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 30.0 p -94.51 -15.38 24.21 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.165 -0.959 . . . . 0.0 109.515 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . 0.602 ' O ' ' NH1' ' A' ' 19' ' ' ARG . . . 63.69 35.68 92.35 Favored Glycine 0 N--CA 1.49 2.239 0 N-CA-C 109.568 -1.413 . . . . 0.0 109.568 179.797 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 54.8 mtpt -125.61 151.35 46.6 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.329 -1.101 . . . . 0.0 109.529 -179.543 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 10.8 tpp -93.54 121.78 35.3 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.257 -0.902 . . . . 0.0 109.405 179.812 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 56.4 tp . . . . . 0 N--CA 1.49 1.559 0 O-C-N 121.179 -0.951 . . . . 0.0 109.416 179.876 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.528 4.789 0 N-CA-C 119.407 2.523 . . . . 0.0 119.407 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.491 ' O ' ' C ' ' A' ' 3' ' ' MET . 11.2 p -84.54 151.76 24.35 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.279 -1.13 . . . . 0.0 109.482 -179.738 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.491 ' C ' ' O ' ' A' ' 2' ' ' SER . 65.9 mtt 40.05 61.92 1.39 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.243 -0.911 . . . . 0.0 109.488 179.645 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 79.6 mt-10 -70.82 130.84 42.74 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.266 -0.896 . . . . 0.0 109.528 179.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 33.8 ptt180 -127.15 135.89 51.33 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.275 -0.891 . . . . 0.0 109.47 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 12.6 mttp -85.26 169.89 13.35 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.25 -0.907 . . . . 0.0 109.539 179.209 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.547 ' NH1' ' OE2' ' A' ' 20' ' ' GLU . 61.8 ttt85 -155.87 95.04 1.6 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.207 -0.933 . . . . 0.0 109.441 -178.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 7.7 m0 -111.24 139.41 46.64 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.247 -0.908 . . . . 0.0 109.475 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -83.43 149.67 26.53 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.276 -0.89 . . . . 0.0 109.467 179.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 34.3 m -114.75 100.46 53.39 Favored Pre-proline 0 N--CA 1.491 1.587 0 O-C-N 121.203 -0.935 . . . . 0.0 109.492 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -55.56 -27.21 58.75 Favored 'Trans proline' 0 C--N 1.305 -1.748 0 C-N-CA 122.877 2.385 . . . . 0.0 112.272 178.3 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.41 -34.48 74.01 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.257 -0.902 . . . . 0.0 109.474 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.413 ' N ' HD23 ' A' ' 13' ' ' LEU . 9.4 mt -90.15 157.46 45.37 Favored Pre-proline 0 N--CA 1.489 1.524 0 O-C-N 121.18 -0.95 . . . . 0.0 109.376 -179.812 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_exo -54.8 145.26 62.08 Favored 'Trans proline' 0 C--N 1.305 -1.723 0 C-N-CA 122.848 2.365 . . . . 0.0 112.185 179.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 94.4 mm-40 -49.57 127.85 16.38 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.323 -0.861 . . . . 0.0 109.463 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 123.88 -18.35 7.55 Favored Glycine 0 N--CA 1.49 2.24 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . 0.405 ' N ' ' CD1' ' A' ' 17' ' ' TRP . 21.1 m95 -93.0 150.74 20.33 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.259 -1.142 . . . . 0.0 109.468 179.14 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.509 ' OE1' ' N ' ' A' ' 18' ' ' GLU . 59.4 mp0 -144.42 160.91 40.28 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.227 -0.92 . . . . 0.0 109.463 -179.474 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.533 ' CZ ' HG11 ' A' ' 35' ' ' VAL . 33.6 ttt180 -121.2 156.88 31.45 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.221 -0.924 . . . . 0.0 109.42 179.286 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.547 ' OE2' ' NH1' ' A' ' 7' ' ' ARG . 95.9 mt-10 -147.23 142.59 27.39 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.221 -0.924 . . . . 0.0 109.524 -179.662 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 80.2 tt0 -115.18 133.85 55.67 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.277 -0.889 . . . . 0.0 109.456 179.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.6 t -129.09 123.29 21.67 Favored Pre-proline 0 N--CA 1.491 1.589 0 O-C-N 121.272 -0.893 . . . . 0.0 109.538 -178.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -77.04 129.86 10.85 Favored 'Trans proline' 0 C--N 1.306 -1.701 0 C-N-CA 122.868 2.379 . . . . 0.0 112.145 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 23.3 mmm180 -80.33 158.17 26.16 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.185 -0.947 . . . . 0.0 109.424 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 82.3 mtp180 -152.54 35.2 0.5 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.252 -0.905 . . . . 0.0 109.518 -179.415 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.489 ' O ' ' C ' ' A' ' 27' ' ' GLY . 58.0 m -103.68 105.84 16.18 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.296 -0.878 . . . . 0.0 109.453 -179.151 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.489 ' C ' ' O ' ' A' ' 26' ' ' SER . . . 38.51 -128.61 1.8 Allowed Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.48 -1.448 . . . . 0.0 109.48 179.039 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.526 ' C ' ' H ' ' A' ' 30' ' ' ALA . 97.0 mt -63.7 -27.79 69.45 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.254 -1.145 . . . . 0.0 109.443 -179.027 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.464 ' N ' ' O ' ' A' ' 26' ' ' SER . 0.5 OUTLIER -69.73 16.38 0.06 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.234 -0.916 . . . . 0.0 109.536 -179.636 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.526 ' H ' ' C ' ' A' ' 28' ' ' LEU . . . -90.62 163.73 14.45 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.3 -0.875 . . . . 0.0 109.431 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 82.19 -38.38 2.58 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.56 -1.416 . . . . 0.0 109.56 179.641 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 -61.27 138.75 58.23 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.225 -1.162 . . . . 0.0 109.453 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 84.7 mtm-85 -115.64 127.61 55.32 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.246 -0.909 . . . . 0.0 109.556 -179.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.451 ' OD1' ' N ' ' A' ' 35' ' ' VAL . 62.8 t0 -106.12 142.55 35.63 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.229 -0.919 . . . . 0.0 109.417 -179.902 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.533 HG11 ' CZ ' ' A' ' 19' ' ' ARG . 46.9 t -111.03 129.4 66.36 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.246 -0.909 . . . . 0.0 109.413 -179.592 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -116.69 145.37 43.49 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.255 -0.903 . . . . 0.0 109.514 179.118 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.627 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 60.2 m-85 -115.05 149.8 36.91 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.273 -0.892 . . . . 0.0 109.472 179.638 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 94.9 m-85 -127.76 140.39 52.09 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.246 -0.909 . . . . 0.0 109.518 179.397 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.47 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -97.91 178.35 1.36 Allowed Pre-proline 0 N--CA 1.489 1.509 0 O-C-N 121.242 -0.911 . . . . 0.0 109.504 179.452 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.47 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 35.6 Cg_exo -56.6 -29.31 78.66 Favored 'Trans proline' 0 C--N 1.305 -1.727 0 C-N-CA 122.826 2.351 . . . . 0.0 112.206 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 91.4 p -87.39 -0.92 57.5 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.164 -0.96 . . . . 0.0 109.485 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 83.53 22.2 56.71 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -74.8 126.06 30.12 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.262 -1.14 . . . . 0.0 109.454 179.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -94.33 121.55 35.97 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.275 -0.89 . . . . 0.0 109.542 179.447 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.636 ' N ' ' CD1' ' A' ' 45' ' ' PHE . 1.2 p90 -141.36 149.83 41.65 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.214 -0.929 . . . . 0.0 109.506 -179.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.93 68.62 1.42 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.256 -0.903 . . . . 0.0 109.464 179.247 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 44.9 m -151.06 130.71 13.09 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.279 -0.888 . . . . 0.0 109.466 179.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.736 ' N ' ' HD2' ' A' ' 49' ' ' PRO . 20.3 tttt -60.73 -53.92 59.61 Favored Pre-proline 0 N--CA 1.49 1.54 0 O-C-N 121.288 -0.882 . . . . 0.0 109.457 -179.517 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.736 ' HD2' ' N ' ' A' ' 48' ' ' LYS . 10.9 Cg_endo -52.99 -38.53 80.02 Favored 'Trans proline' 0 C--N 1.304 -1.766 0 C-N-CA 122.853 2.369 . . . . 0.0 112.203 -179.521 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -64.66 -36.95 85.91 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.205 -0.934 . . . . 0.0 109.521 178.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 4.1 mt -64.75 -44.53 89.8 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.284 -0.885 . . . . 0.0 109.429 179.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.696 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -73.79 -45.57 50.78 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.213 -0.929 . . . . 0.0 109.485 -179.219 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -60.88 -44.52 96.97 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.265 -0.897 . . . . 0.0 109.489 -179.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 29.0 t80 -66.8 -54.17 25.38 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.312 -0.868 . . . . 0.0 109.492 -179.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 94.6 mt -91.84 10.58 28.02 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.224 -0.923 . . . . 0.0 109.479 -179.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.696 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -49.61 -71.08 0.66 Allowed Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 -179.63 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -54.07 -44.06 73.25 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 109.568 -1.413 . . . . 0.0 109.568 -179.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 95.8 p -59.36 -29.66 67.84 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.231 -1.158 . . . . 0.0 109.463 -179.666 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.661 ' SD ' HD21 ' A' ' 61' ' ' LEU . 0.0 OUTLIER 179.5 173.38 0.86 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.229 -0.919 . . . . 0.0 109.479 -179.856 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 90.6 m-20 -102.24 123.48 46.15 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.287 -0.883 . . . . 0.0 109.477 179.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.661 HD21 ' SD ' ' A' ' 59' ' ' MET . 98.6 mt -116.88 13.69 15.03 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.236 -0.915 . . . . 0.0 109.483 -179.586 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 92.9 p -56.11 -33.9 65.55 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.27 -0.894 . . . . 0.0 109.475 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 21.5 p -92.88 19.77 7.32 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.218 -0.926 . . . . 0.0 109.519 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -88.57 135.6 33.41 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.204 -0.935 . . . . 0.0 109.445 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.518 ' O ' ' N ' ' A' ' 69' ' ' GLY . 51.8 t0 -87.38 111.56 21.22 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.192 -0.943 . . . . 0.0 109.481 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.627 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 74.6 t80 -75.91 -41.68 51.15 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.227 -0.92 . . . . 0.0 109.527 -179.323 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.422 ' HD2' ' N ' ' A' ' 67' ' ' ARG . 3.2 mpt_? -62.12 -39.51 92.78 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.199 -0.938 . . . . 0.0 109.494 -179.046 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.458 ' OG1' ' CG ' ' A' ' 65' ' ' ASP . 44.0 p -103.05 -13.41 16.85 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.309 -0.869 . . . . 0.0 109.471 -178.447 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.518 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 62.79 42.37 99.69 Favored Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.476 ' H ' ' HB3' ' A' ' 65' ' ' ASP . 68.6 mttm -132.71 154.5 50.12 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.227 -1.161 . . . . 0.0 109.488 -179.775 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 57.0 ttm -91.61 125.13 36.23 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.291 -0.881 . . . . 0.0 109.514 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 8.6 tp . . . . . 0 N--CA 1.489 1.525 0 O-C-N 121.259 -0.901 . . . . 0.0 109.479 179.85 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.528 4.796 0 N-CA-C 119.461 2.544 . . . . 0.0 119.461 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 42.3 t -72.38 133.2 44.8 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.225 -1.162 . . . . 0.0 109.529 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 5.5 ttt -106.8 119.2 38.7 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.268 -0.895 . . . . 0.0 109.487 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -145.92 80.83 1.59 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.224 -0.923 . . . . 0.0 109.531 179.658 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 85.0 mtp180 -106.05 113.71 27.42 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.253 -0.905 . . . . 0.0 109.479 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.436 ' O ' ' HA ' ' A' ' 20' ' ' GLU . 0.5 OUTLIER -111.14 106.18 15.13 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.264 -0.897 . . . . 0.0 109.53 179.917 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 56.0 ttp180 -102.13 118.12 36.22 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.181 -0.95 . . . . 0.0 109.34 -179.466 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.559 ' CD1' ' N ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -124.99 144.56 50.32 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.221 -0.924 . . . . 0.0 109.429 179.603 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -57.43 141.27 47.97 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.207 -0.933 . . . . 0.0 109.443 -179.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.5 ' SG ' ' C ' ' A' ' 17' ' ' TRP . 0.8 OUTLIER -96.64 123.03 55.52 Favored Pre-proline 0 N--CA 1.491 1.588 0 O-C-N 121.254 -0.904 . . . . 0.0 109.51 179.72 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -73.75 -32.87 7.02 Favored 'Trans proline' 0 C--N 1.304 -1.771 0 C-N-CA 122.88 2.387 . . . . 0.0 112.249 -178.77 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.0 -38.02 85.26 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.337 -0.852 . . . . 0.0 109.516 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.578 ' CD1' ' N ' ' A' ' 13' ' ' LEU . 5.1 mp -84.01 156.59 63.8 Favored Pre-proline 0 N--CA 1.49 1.566 0 O-C-N 121.277 -0.889 . . . . 0.0 109.52 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -49.72 155.75 3.63 Favored 'Trans proline' 0 C--N 1.306 -1.699 0 C-N-CA 122.774 2.316 . . . . 0.0 112.284 179.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -56.29 123.73 15.61 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.19 -0.944 . . . . 0.0 109.468 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 123.26 -33.99 3.82 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 179.445 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . 0.5 ' C ' ' SG ' ' A' ' 10' ' ' CYS . 49.8 m95 -71.31 149.59 45.97 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.308 -1.113 . . . . 0.0 109.481 179.222 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 68.3 mt-10 -145.32 157.98 43.93 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.345 -0.847 . . . . 0.0 109.54 -178.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.426 ' NH1' ' O ' ' A' ' 68' ' ' THR . 21.1 ptt180 -141.59 145.62 35.28 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.3 -0.875 . . . . 0.0 109.432 179.046 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.436 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 19.2 pt-20 -130.39 143.3 50.68 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.226 -0.921 . . . . 0.0 109.584 -179.385 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -98.59 136.99 37.89 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.267 -0.896 . . . . 0.0 109.471 178.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 30.7 t -143.13 100.92 5.3 Favored Pre-proline 0 N--CA 1.49 1.575 0 O-C-N 121.23 -0.919 . . . . 0.0 109.529 -179.172 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_exo -56.69 136.51 76.58 Favored 'Trans proline' 0 C--N 1.305 -1.726 0 C-N-CA 122.872 2.382 . . . . 0.0 112.185 177.388 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 23.0 ptt180 -119.04 90.96 3.44 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.239 -0.913 . . . . 0.0 109.491 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 52.7 ptt85 -92.87 20.21 6.85 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.27 -0.894 . . . . 0.0 109.428 178.756 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 32.8 m -134.14 113.86 12.51 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.16 -0.962 . . . . 0.0 109.456 -179.198 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 155.64 -168.01 33.2 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.595 -1.402 . . . . 0.0 109.595 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.4 ' HA ' HD23 ' A' ' 28' ' ' LEU . 94.3 mt -79.88 -50.2 10.82 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.257 -1.143 . . . . 0.0 109.473 179.355 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.501 ' O ' ' O ' ' A' ' 30' ' ' ALA . 65.2 p -96.77 24.26 6.25 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.301 -0.875 . . . . 0.0 109.442 178.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.501 ' O ' ' O ' ' A' ' 29' ' ' SER . . . -44.03 170.39 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.245 -0.909 . . . . 0.0 109.487 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 110.03 -31.12 7.72 Favored Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.591 -1.404 . . . . 0.0 109.591 -179.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 28.9 m170 -96.96 174.79 6.59 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.226 -1.161 . . . . 0.0 109.468 -179.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 50.5 ptt85 -118.35 137.53 53.03 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.351 -0.843 . . . . 0.0 109.465 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.409 ' OD1' ' N ' ' A' ' 35' ' ' VAL . 64.0 t0 -104.16 133.92 48.27 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.26 -0.9 . . . . 0.0 109.438 -179.495 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.409 ' N ' ' OD1' ' A' ' 34' ' ' ASP . 57.7 t -109.68 132.91 56.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 O-C-N 121.26 -0.9 . . . . 0.0 109.442 179.379 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -111.72 141.81 44.87 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.233 -0.917 . . . . 0.0 109.388 -179.176 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.541 ' CE1' ' CZ ' ' A' ' 66' ' ' PHE . 44.1 m-85 -114.81 143.25 45.38 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.25 -0.907 . . . . 0.0 109.475 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 87.8 m-85 -122.91 133.34 54.41 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.182 -0.949 . . . . 0.0 109.513 -179.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.472 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.4 OUTLIER -98.59 178.59 1.26 Allowed Pre-proline 0 N--CA 1.491 1.576 0 O-C-N 121.262 -0.899 . . . . 0.0 109.486 179.58 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.472 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 48.7 Cg_exo -54.6 -29.92 62.99 Favored 'Trans proline' 0 C--N 1.305 -1.752 0 C-N-CA 122.853 2.369 . . . . 0.0 112.206 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 96.4 p -85.89 7.82 22.65 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.272 -0.892 . . . . 0.0 109.485 179.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 72.71 8.59 72.76 Favored Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 -179.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 3.8 tmmt? -67.49 128.99 38.49 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.298 -1.119 . . . . 0.0 109.492 -179.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 51.9 pttt -99.14 130.34 45.45 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.262 -0.899 . . . . 0.0 109.451 179.02 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.491 ' N ' ' CD1' ' A' ' 45' ' ' PHE . 9.8 p90 -141.69 149.19 40.24 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.306 -0.872 . . . . 0.0 109.479 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 25.7 ptt-85 -130.84 50.69 2.2 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.176 -0.952 . . . . 0.0 109.486 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -159.27 143.87 15.45 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.226 -0.921 . . . . 0.0 109.478 -179.888 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.633 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 10.6 tttt -60.14 -44.67 96.99 Favored Pre-proline 0 N--CA 1.489 1.501 0 O-C-N 121.205 -0.934 . . . . 0.0 109.515 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.633 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 47.3 Cg_exo -55.99 -38.69 94.33 Favored 'Trans proline' 0 C--N 1.305 -1.741 0 C-N-CA 122.855 2.37 . . . . 0.0 112.192 179.706 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 94.9 mm-40 -67.57 -37.97 83.4 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.259 -0.901 . . . . 0.0 109.482 179.535 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.46 ' CD1' ' CZ3' ' A' ' 17' ' ' TRP . 57.8 tp -61.04 -45.58 94.19 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.307 -0.871 . . . . 0.0 109.509 179.747 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.517 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -68.59 -40.37 80.51 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.241 -0.912 . . . . 0.0 109.392 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 77.7 ttt-85 -53.5 -44.65 69.25 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.328 -0.857 . . . . 0.0 109.478 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 50.5 t80 -66.31 -49.2 67.86 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.242 -0.911 . . . . 0.0 109.423 179.365 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.583 ' O ' ' N ' ' A' ' 57' ' ' GLY . 98.6 mt -80.75 4.87 17.5 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.25 -0.906 . . . . 0.0 109.454 179.753 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.517 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . 60.11 -74.6 0.01 OUTLIER Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.561 -1.416 . . . . 0.0 109.561 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . 0.583 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . 177.28 37.66 0.06 OUTLIER Glycine 0 N--CA 1.49 2.241 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 -179.712 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 87.1 p -93.34 8.32 40.91 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.23 -1.159 . . . . 0.0 109.45 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 99.7 mtp -145.87 139.83 26.59 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.23 -0.918 . . . . 0.0 109.5 -179.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.404 ' OD1' ' N ' ' A' ' 60' ' ' ASP . 38.4 p-10 -80.53 96.02 6.67 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.103 -0.998 . . . . 0.0 109.494 179.572 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 90.1 mt -95.41 -1.83 50.19 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.286 -0.884 . . . . 0.0 109.48 -179.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 35.8 t -53.96 -29.83 44.37 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.182 -0.949 . . . . 0.0 109.505 179.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 69.4 p -106.91 18.49 21.75 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.302 -0.874 . . . . 0.0 109.527 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.437 ' O ' ' CE ' ' A' ' 48' ' ' LYS . 14.8 t80 -88.22 124.73 34.14 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.215 -0.928 . . . . 0.0 109.51 -179.746 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.415 ' O ' ' N ' ' A' ' 69' ' ' GLY . 7.8 m-20 -79.92 113.57 18.18 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.302 -0.874 . . . . 0.0 109.451 -179.535 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.541 ' CZ ' ' CE1' ' A' ' 37' ' ' TYR . 58.5 t80 -79.24 -42.21 26.45 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.293 -0.879 . . . . 0.0 109.442 -179.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 83.7 mmt-85 -62.86 -40.17 96.67 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.199 -0.938 . . . . 0.0 109.453 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.426 ' O ' ' NH1' ' A' ' 19' ' ' ARG . 27.6 p -97.78 -13.62 21.26 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.335 -0.853 . . . . 0.0 109.472 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.415 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 61.62 40.41 98.71 Favored Glycine 0 N--CA 1.489 2.204 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 -179.844 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -128.67 149.7 50.56 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.172 -1.193 . . . . 0.0 109.437 -179.627 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 36.6 ttm -94.12 112.86 24.71 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.267 -0.896 . . . . 0.0 109.397 179.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.437 HD22 ' HA ' ' A' ' 72' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.533 0 O-C-N 121.287 -0.883 . . . . 0.0 109.41 -179.88 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.529 4.897 0 N-CA-C 119.447 2.539 . . . . 0.0 119.447 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.2 m 48.1 90.34 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.157 -1.202 . . . . 0.0 109.467 -179.547 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 6.5 ptp -60.84 136.68 58.15 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.245 -0.909 . . . . 0.0 109.41 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -103.99 152.75 21.64 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.275 -0.891 . . . . 0.0 109.428 -179.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.4 tpt180 60.87 75.15 0.42 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.336 -0.852 . . . . 0.0 109.459 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 31.1 mttt -79.4 169.69 17.7 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.291 -0.88 . . . . 0.0 109.462 -179.64 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.574 ' O ' ' CD1' ' A' ' 8' ' ' TRP . 79.0 mtp85 -143.66 135.12 26.08 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.324 -0.86 . . . . 0.0 109.455 -178.701 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.574 ' CD1' ' O ' ' A' ' 7' ' ' ARG . 6.3 m0 -157.85 129.09 6.63 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.207 -0.933 . . . . 0.0 109.438 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 45.8 tt0 -86.9 121.58 29.58 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.149 -0.97 . . . . 0.0 109.556 178.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.467 ' CA ' HH12 ' A' ' 19' ' ' ARG . 0.0 OUTLIER -79.61 123.85 83.97 Favored Pre-proline 0 N--CA 1.49 1.532 0 O-C-N 121.316 -0.865 . . . . 0.0 109.479 -179.444 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -71.8 -13.53 29.46 Favored 'Trans proline' 0 C--N 1.305 -1.721 0 C-N-CA 122.797 2.331 . . . . 0.0 112.235 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.563 ' HB3' ' CE1' ' A' ' 64' ' ' PHE . . . -82.64 -14.72 54.22 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.279 -0.888 . . . . 0.0 109.531 179.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.618 HD21 HD11 ' A' ' 51' ' ' LEU . 5.8 mp -100.38 156.07 35.66 Favored Pre-proline 0 N--CA 1.49 1.571 0 O-C-N 121.161 -0.962 . . . . 0.0 109.428 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.577 ' CG ' HD11 ' A' ' 55' ' ' LEU . 31.5 Cg_exo -57.1 142.09 94.27 Favored 'Trans proline' 0 C--N 1.305 -1.741 0 C-N-CA 122.911 2.407 . . . . 0.0 112.202 178.791 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -47.77 128.82 13.6 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.323 -0.86 . . . . 0.0 109.411 179.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 117.83 -17.79 11.82 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 -179.617 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . 0.403 ' NE1' ' HD3' ' A' ' 40' ' ' PRO . 24.3 m95 -92.09 151.77 20.26 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.365 -1.079 . . . . 0.0 109.458 179.866 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -151.05 164.8 35.59 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.252 -0.905 . . . . 0.0 109.502 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.467 HH12 ' CA ' ' A' ' 10' ' ' CYS . 35.9 ptt-85 -142.7 149.13 38.41 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.29 -0.881 . . . . 0.0 109.509 179.331 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -124.51 162.94 22.93 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.26 -0.9 . . . . 0.0 109.509 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -117.54 135.66 53.79 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.302 -0.874 . . . . 0.0 109.388 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.4 t -131.32 115.2 16.15 Favored Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.261 -0.899 . . . . 0.0 109.546 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -76.58 142.02 22.81 Favored 'Trans proline' 0 C--N 1.304 -1.786 0 C-N-CA 122.91 2.407 . . . . 0.0 112.13 -179.262 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 23.0 mmt180 -82.44 156.55 24.06 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.247 -0.908 . . . . 0.0 109.579 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.465 ' O ' ' O ' ' A' ' 26' ' ' SER . 43.1 ttm180 -120.23 124.3 45.35 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.303 -0.873 . . . . 0.0 109.495 -179.778 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.465 ' O ' ' O ' ' A' ' 25' ' ' ARG . 1.2 p 55.78 164.48 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.27 -0.894 . . . . 0.0 109.474 179.573 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.535 ' C ' ' H ' ' A' ' 29' ' ' SER . . . 98.89 155.0 28.95 Favored Glycine 0 N--CA 1.49 2.244 0 N-CA-C 109.487 -1.445 . . . . 0.0 109.487 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.529 ' N ' HD12 ' A' ' 28' ' ' LEU . 11.1 mp -58.03 -0.51 0.08 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.205 -1.173 . . . . 0.0 109.462 179.306 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.535 ' H ' ' C ' ' A' ' 27' ' ' GLY . 3.8 t -104.09 29.01 6.24 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.262 -0.899 . . . . 0.0 109.499 -179.595 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.8 139.9 53.26 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.186 -0.946 . . . . 0.0 109.352 -179.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 84.69 -14.61 46.47 Favored Glycine 0 N--CA 1.49 2.256 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 179.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 31.6 m170 -78.42 122.13 25.42 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.329 -1.101 . . . . 0.0 109.426 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -108.78 111.94 23.96 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.316 -0.865 . . . . 0.0 109.495 -179.601 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 87.3 m-20 -84.69 139.3 32.11 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.285 -0.884 . . . . 0.0 109.433 179.086 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 42.6 t -113.82 128.74 70.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.298 -0.876 . . . . 0.0 109.453 -179.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.417 ' CE2' ' HD3' ' A' ' 46' ' ' ARG . 67.2 m-85 -105.62 142.81 34.71 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.324 -0.86 . . . . 0.0 109.437 179.608 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.552 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 68.4 m-85 -109.66 144.5 37.93 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.285 -0.884 . . . . 0.0 109.44 -179.406 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 -128.22 141.81 51.35 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.246 -0.909 . . . . 0.0 109.543 -179.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.461 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.4 OUTLIER -99.95 177.04 1.66 Allowed Pre-proline 0 N--CA 1.489 1.52 0 O-C-N 121.254 -0.904 . . . . 0.0 109.506 179.485 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.461 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 47.1 Cg_exo -55.45 -35.43 92.1 Favored 'Trans proline' 0 C--N 1.306 -1.704 0 C-N-CA 122.77 2.313 . . . . 0.0 112.31 -178.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 68.1 m -80.35 -4.4 53.31 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.206 -0.934 . . . . 0.0 109.482 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 89.42 16.0 57.78 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 179.722 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -66.75 122.15 17.02 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.262 -1.14 . . . . 0.0 109.471 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.403 ' CE ' ' CD2' ' A' ' 36' ' ' PHE . 87.4 tttt -93.99 123.03 37.09 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.267 -0.896 . . . . 0.0 109.472 179.306 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.609 ' N ' ' CD1' ' A' ' 45' ' ' PHE . 1.6 p90 -140.92 148.37 40.32 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.335 -0.853 . . . . 0.0 109.418 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.417 ' HD3' ' CE2' ' A' ' 36' ' ' PHE . 65.7 ttp85 -134.07 65.46 1.57 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.184 -0.947 . . . . 0.0 109.508 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.9 m -150.12 130.28 13.6 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.231 -0.918 . . . . 0.0 109.452 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.719 ' N ' ' HD2' ' A' ' 49' ' ' PRO . 24.1 tttt -62.8 -54.08 50.43 Favored Pre-proline 0 N--CA 1.49 1.53 0 O-C-N 121.279 -0.888 . . . . 0.0 109.489 -179.857 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.719 ' HD2' ' N ' ' A' ' 48' ' ' LYS . 18.9 Cg_endo -57.65 -38.66 92.65 Favored 'Trans proline' 0 C--N 1.306 -1.692 0 C-N-CA 122.792 2.328 . . . . 0.0 112.198 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -65.39 -39.73 92.57 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.28 -0.887 . . . . 0.0 109.5 179.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.779 HD23 ' O ' ' A' ' 51' ' ' LEU . 5.1 tt -69.29 -41.15 77.2 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.26 -0.9 . . . . 0.0 109.536 179.797 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.576 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -62.62 -43.02 99.86 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.185 -0.947 . . . . 0.0 109.472 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.493 HH12 ' HB2' ' A' ' 49' ' ' PRO . 92.6 mtm-85 -59.45 -42.51 92.14 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.306 -0.871 . . . . 0.0 109.479 179.492 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -59.78 -50.23 74.63 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.396 -0.815 . . . . 0.0 109.508 179.127 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.577 HD11 ' CG ' ' A' ' 14' ' ' PRO . 3.6 mm? -85.78 -0.13 54.43 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.186 -0.946 . . . . 0.0 109.491 178.383 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.576 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -61.87 97.6 0.16 Allowed Glycine 0 N--CA 1.492 2.367 0 N-CA-C 109.506 -1.438 . . . . 0.0 109.506 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 132.26 -63.98 0.62 Allowed Glycine 0 N--CA 1.489 2.226 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 76.2 p -69.88 -24.75 63.46 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.182 -1.187 . . . . 0.0 109.574 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.569 ' HB3' HD12 ' A' ' 55' ' ' LEU . 55.1 ttm -159.3 149.5 19.13 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.229 -0.92 . . . . 0.0 109.475 -179.717 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.569 ' C ' HD12 ' A' ' 61' ' ' LEU . 49.8 t0 -95.16 117.04 29.54 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.235 -0.916 . . . . 0.0 109.45 179.63 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.569 HD12 ' C ' ' A' ' 60' ' ' ASP . 10.7 mp -113.44 10.23 18.24 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.336 -0.853 . . . . 0.0 109.433 -179.392 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 50.3 m -52.44 -37.28 56.54 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.234 -0.916 . . . . 0.0 109.463 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 17.9 p -92.62 18.83 8.11 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.188 -0.945 . . . . 0.0 109.485 179.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.563 ' CE1' ' HB3' ' A' ' 12' ' ' ALA . 70.0 t80 -90.99 132.58 35.9 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.19 -0.944 . . . . 0.0 109.387 179.628 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.503 ' O ' ' N ' ' A' ' 69' ' ' GLY . 60.7 t0 -82.63 112.65 19.71 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.205 -0.935 . . . . 0.0 109.563 179.911 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.552 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 73.7 t80 -75.17 -44.3 47.43 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.207 -0.933 . . . . 0.0 109.417 -179.23 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 13.7 tpt180 -58.06 -44.5 87.49 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.263 -0.898 . . . . 0.0 109.423 -179.118 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.452 ' OG1' ' CG ' ' A' ' 65' ' ' ASP . 49.7 p -97.13 -12.94 22.49 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.292 -0.88 . . . . 0.0 109.468 -179.288 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.503 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 61.65 40.86 99.32 Favored Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -130.77 156.24 45.3 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.314 -1.109 . . . . 0.0 109.453 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.483 ' HB2' ' HB2' ' A' ' 12' ' ' ALA . 5.4 ttm -94.98 120.43 35.18 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.267 -0.895 . . . . 0.0 109.492 179.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.448 HD22 ' HA ' ' A' ' 72' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.573 0 O-C-N 121.269 -0.894 . . . . 0.0 109.424 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.529 4.841 0 N-CA-C 119.473 2.549 . . . . 0.0 119.473 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.463 ' OG ' ' N ' ' A' ' 3' ' ' MET . 71.2 p -125.47 -65.02 1.03 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.251 -1.146 . . . . 0.0 109.512 -179.803 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.463 ' N ' ' OG ' ' A' ' 2' ' ' SER . 77.8 mtm -84.92 135.63 33.97 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.229 -0.919 . . . . 0.0 109.417 -179.548 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -64.55 142.36 58.45 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.27 -0.894 . . . . 0.0 109.457 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.419 ' HD2' ' N ' ' A' ' 5' ' ' ARG . 11.7 mpt_? -51.73 178.65 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.189 -0.945 . . . . 0.0 109.398 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.58 96.84 7.63 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.263 -0.898 . . . . 0.0 109.529 -179.6 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.444 ' O ' ' CG ' ' A' ' 8' ' ' TRP . 99.3 mtt180 -71.81 167.59 19.65 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.254 -0.904 . . . . 0.0 109.5 179.604 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.444 ' CG ' ' O ' ' A' ' 7' ' ' ARG . 0.8 OUTLIER -166.21 144.66 5.66 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.17 -0.956 . . . . 0.0 109.514 -179.716 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.465 ' N ' ' OE1' ' A' ' 9' ' ' GLU . 58.7 mp0 -92.56 137.05 32.7 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.25 -0.906 . . . . 0.0 109.454 179.73 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.539 ' SG ' ' O ' ' A' ' 69' ' ' GLY . 0.5 OUTLIER -115.11 101.44 54.49 Favored Pre-proline 0 N--CA 1.49 1.529 0 O-C-N 121.301 -0.874 . . . . 0.0 109.567 -179.831 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -51.3 -37.79 60.83 Favored 'Trans proline' 0 C--N 1.306 -1.683 0 C-N-CA 122.872 2.381 . . . . 0.0 112.208 179.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.94 -24.3 64.25 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.213 -0.929 . . . . 0.0 109.511 179.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 7.2 mp -87.41 157.13 53.43 Favored Pre-proline 0 N--CA 1.49 1.554 0 O-C-N 121.324 -0.86 . . . . 0.0 109.542 179.491 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.461 ' HG2' ' CD1' ' A' ' 17' ' ' TRP . 18.0 Cg_endo -59.8 140.76 94.79 Favored 'Trans proline' 0 C--N 1.305 -1.742 0 C-N-CA 122.802 2.334 . . . . 0.0 112.172 -179.694 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -53.18 121.49 7.61 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.279 -0.888 . . . . 0.0 109.524 -179.175 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 122.6 -27.48 5.98 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 179.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . 0.461 ' CD1' ' HG2' ' A' ' 14' ' ' PRO . 11.5 m95 -83.69 154.45 23.65 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.343 -1.093 . . . . 0.0 109.553 179.728 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -143.68 157.94 44.03 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.325 -0.86 . . . . 0.0 109.455 -179.436 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.57 ' NH1' ' O ' ' A' ' 69' ' ' GLY . 33.8 ptt180 -124.42 163.56 21.53 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.244 -0.91 . . . . 0.0 109.485 179.777 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -141.8 140.92 33.13 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.284 -0.885 . . . . 0.0 109.571 -179.172 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 28.5 tp10 -101.89 122.36 43.86 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.317 -0.865 . . . . 0.0 109.438 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.419 HG13 ' HE ' ' A' ' 5' ' ' ARG . 2.5 t -118.25 98.47 51.41 Favored Pre-proline 0 N--CA 1.49 1.529 0 O-C-N 121.17 -0.956 . . . . 0.0 109.639 -179.778 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -58.58 128.04 26.8 Favored 'Trans proline' 0 C--N 1.305 -1.712 0 C-N-CA 122.851 2.367 . . . . 0.0 112.184 179.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.421 ' NE ' ' HB2' ' A' ' 34' ' ' ASP . 99.5 mtt180 -90.31 164.19 14.45 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.148 -0.97 . . . . 0.0 109.462 178.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 89.7 mtm180 -136.75 25.3 3.09 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.362 -0.836 . . . . 0.0 109.418 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.92 178.6 4.81 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.312 -0.868 . . . . 0.0 109.51 -179.837 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -68.8 -84.23 0.14 Allowed Glycine 0 N--CA 1.489 2.227 0 N-CA-C 109.489 -1.444 . . . . 0.0 109.489 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.517 HD22 ' N ' ' A' ' 28' ' ' LEU . 3.8 mm? -61.95 -38.71 89.53 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.162 -1.199 . . . . 0.0 109.511 -179.454 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -76.08 22.55 0.15 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.204 -0.935 . . . . 0.0 109.432 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.451 ' H ' ' C ' ' A' ' 28' ' ' LEU . . . -71.26 142.62 50.53 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.109 -0.995 . . . . 0.0 109.432 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 77.16 -12.51 12.36 Favored Glycine 0 N--CA 1.492 2.389 0 N-CA-C 109.514 -1.434 . . . . 0.0 109.514 179.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 73.6 m80 -75.73 130.46 38.71 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.221 -1.164 . . . . 0.0 109.475 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 94.9 mtt-85 -110.59 121.51 45.5 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.26 -0.9 . . . . 0.0 109.518 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.421 ' HB2' ' NE ' ' A' ' 24' ' ' ARG . 58.6 t0 -84.38 136.68 33.78 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.318 -0.864 . . . . 0.0 109.474 179.32 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 25.0 t -111.06 128.16 67.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.267 -0.896 . . . . 0.0 109.502 -179.128 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 52.9 m-85 -117.44 147.15 42.97 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.245 -0.909 . . . . 0.0 109.499 179.098 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 -117.8 148.96 41.58 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.195 -0.941 . . . . 0.0 109.363 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.425 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 12.9 m-85 -133.21 144.59 49.9 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.216 -0.928 . . . . 0.0 109.579 -178.759 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.6 p -103.38 159.44 29.28 Favored Pre-proline 0 N--CA 1.491 1.584 0 O-C-N 121.24 -0.913 . . . . 0.0 109.474 179.051 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -54.01 -16.36 9.01 Favored 'Trans proline' 0 C--N 1.304 -1.779 0 C-N-CA 122.788 2.325 . . . . 0.0 112.271 178.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 4.5 m -86.15 -2.16 58.09 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.242 -0.911 . . . . 0.0 109.526 179.081 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 84.83 5.83 85.94 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 41.6 tttp -75.67 119.61 19.93 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.255 -1.144 . . . . 0.0 109.38 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -93.53 121.98 35.49 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.221 -0.924 . . . . 0.0 109.487 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.456 ' CZ ' ' CZ3' ' A' ' 17' ' ' TRP . 2.7 p90 -141.0 149.69 42.09 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.252 -0.905 . . . . 0.0 109.437 178.865 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.696 ' O ' ' C ' ' A' ' 47' ' ' SER . 70.8 ttp85 -124.58 -72.54 0.67 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.321 -0.862 . . . . 0.0 109.463 179.815 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.696 ' C ' ' O ' ' A' ' 46' ' ' ARG . 0.7 OUTLIER -21.26 130.41 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.321 -0.862 . . . . 0.0 109.503 179.664 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.656 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 4.8 tttm -65.74 -42.79 57.01 Favored Pre-proline 0 N--CA 1.491 1.584 0 O-C-N 121.171 -0.956 . . . . 0.0 109.498 179.866 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.656 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 49.8 Cg_exo -54.77 -49.62 16.12 Favored 'Trans proline' 0 C--N 1.306 -1.704 0 C-N-CA 122.831 2.354 . . . . 0.0 112.253 -179.521 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.422 ' HG2' ' N ' ' A' ' 51' ' ' LEU . 0.6 OUTLIER -68.01 -33.78 75.25 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.282 -0.886 . . . . 0.0 109.546 179.765 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.422 ' N ' ' HG2' ' A' ' 50' ' ' GLN . 6.9 tt -62.55 -43.88 97.73 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.281 -0.887 . . . . 0.0 109.46 179.68 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -69.84 -40.21 75.95 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.238 -0.914 . . . . 0.0 109.503 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 70.8 ttp85 -58.44 -44.15 89.04 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.291 -0.881 . . . . 0.0 109.535 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 42.8 t80 -59.54 -50.68 72.98 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.228 -0.92 . . . . 0.0 109.545 179.51 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.406 HD21 ' CZ2' ' A' ' 17' ' ' TRP . 80.1 mt -58.12 -43.15 87.05 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.158 -0.964 . . . . 0.0 109.47 179.278 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.412 ' O ' ' C ' ' A' ' 57' ' ' GLY . . . 65.35 83.07 0.1 OUTLIER Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 179.086 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . 0.412 ' C ' ' O ' ' A' ' 56' ' ' GLY . . . 44.08 72.95 0.28 Allowed Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.515 -1.434 . . . . 0.0 109.515 179.058 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 6.9 m -119.5 -26.7 5.71 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.256 -1.144 . . . . 0.0 109.509 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.587 ' SD ' HD21 ' A' ' 61' ' ' LEU . 0.2 OUTLIER -169.34 160.0 9.12 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.29 -0.881 . . . . 0.0 109.506 179.94 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 50.5 t0 -80.6 92.36 5.94 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.345 -0.847 . . . . 0.0 109.5 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.587 HD21 ' SD ' ' A' ' 59' ' ' MET . 96.0 mt -100.98 -0.56 36.35 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.279 -0.888 . . . . 0.0 109.402 -179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 5.0 t -54.4 -30.84 53.49 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.268 -0.895 . . . . 0.0 109.522 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 76.0 p -92.27 11.49 25.63 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.225 -0.922 . . . . 0.0 109.437 179.723 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.41 ' CZ ' ' C ' ' A' ' 69' ' ' GLY . 74.3 t80 -86.89 131.78 34.01 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.27 -0.894 . . . . 0.0 109.519 -179.74 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.518 ' O ' ' N ' ' A' ' 69' ' ' GLY . 55.8 t0 -82.94 114.82 21.48 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.266 -0.896 . . . . 0.0 109.478 -179.629 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 24.2 t80 -75.18 -47.42 28.45 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.179 -0.95 . . . . 0.0 109.523 -179.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 7.7 mmt85 -55.22 -42.33 73.23 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.133 -0.98 . . . . 0.0 109.478 -179.002 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.404 ' OG1' ' CG ' ' A' ' 65' ' ' ASP . 33.2 p -98.69 -13.97 20.02 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.223 -0.923 . . . . 0.0 109.53 -179.455 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.57 ' O ' ' NH1' ' A' ' 19' ' ' ARG . . . 61.07 40.85 99.1 Favored Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 179.777 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -134.8 153.77 51.89 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.297 -1.12 . . . . 0.0 109.492 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 12.8 ttm -87.41 126.28 34.78 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.271 -0.893 . . . . 0.0 109.479 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 72' ' ' LEU . 97.0 mt . . . . . 0 N--CA 1.489 1.506 0 O-C-N 121.239 -0.913 . . . . 0.0 109.501 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.528 4.817 0 N-CA-C 119.405 2.522 . . . . 0.0 119.405 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.6 p -73.14 162.52 29.33 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.262 -1.14 . . . . 0.0 109.552 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 77.3 mtm -83.73 63.16 7.31 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.224 -0.923 . . . . 0.0 109.436 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.486 ' O ' ' O ' ' A' ' 5' ' ' ARG . 17.4 pt-20 -87.43 154.53 20.58 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.257 -0.902 . . . . 0.0 109.432 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.486 ' O ' ' O ' ' A' ' 4' ' ' GLU . 61.0 ttp180 54.02 106.61 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.254 -0.904 . . . . 0.0 109.423 -179.685 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.4 mptt -120.9 113.96 20.87 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.25 -0.906 . . . . 0.0 109.447 179.766 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.448 ' CZ ' ' OE2' ' A' ' 18' ' ' GLU . 14.8 ttp180 -96.36 118.05 32.11 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.285 -0.884 . . . . 0.0 109.468 -179.548 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 5.1 m0 -106.43 156.26 18.72 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.3 -0.875 . . . . 0.0 109.502 179.464 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 84.9 tt0 -72.45 148.73 44.86 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.3 -0.875 . . . . 0.0 109.51 -179.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.592 ' SG ' ' CZ ' ' A' ' 19' ' ' ARG . 74.8 m -106.69 104.83 52.86 Favored Pre-proline 0 N--CA 1.49 1.559 0 O-C-N 121.244 -0.91 . . . . 0.0 109.473 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.405 ' HD2' HH22 ' A' ' 19' ' ' ARG . 55.5 Cg_endo -76.56 -21.19 13.24 Favored 'Trans proline' 0 C--N 1.306 -1.671 0 C-N-CA 122.78 2.32 . . . . 0.0 112.241 -179.565 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -84.24 -34.91 23.76 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.225 -0.922 . . . . 0.0 109.498 179.498 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.618 ' CD1' ' N ' ' A' ' 13' ' ' LEU . 4.6 mp -82.6 156.48 68.13 Favored Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.215 -0.928 . . . . 0.0 109.435 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -51.64 140.26 46.24 Favored 'Trans proline' 0 C--N 1.305 -1.722 0 C-N-CA 122.827 2.352 . . . . 0.0 112.192 179.352 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.602 ' NE2' ' H ' ' A' ' 15' ' ' GLN . 4.0 mp0 -45.85 122.85 4.01 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.27 -0.894 . . . . 0.0 109.448 -179.836 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 123.25 -18.86 7.77 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.59 -1.404 . . . . 0.0 109.59 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . 0.708 ' CZ2' HD21 ' A' ' 55' ' ' LEU . 26.5 m95 -92.65 151.18 20.24 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.176 -1.191 . . . . 0.0 109.499 179.405 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.448 ' OE2' ' CZ ' ' A' ' 7' ' ' ARG . 71.3 mt-10 -148.89 162.51 39.71 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.181 -0.949 . . . . 0.0 109.487 -179.399 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.592 ' CZ ' ' SG ' ' A' ' 10' ' ' CYS . 10.9 ptp85 -140.04 146.11 38.57 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.298 -0.876 . . . . 0.0 109.492 179.58 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -139.13 146.71 40.98 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.203 -0.935 . . . . 0.0 109.471 -178.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -103.1 140.14 37.7 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.311 -0.868 . . . . 0.0 109.47 178.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.0 t -141.6 123.48 9.12 Favored Pre-proline 0 N--CA 1.491 1.598 0 O-C-N 121.227 -0.921 . . . . 0.0 109.584 -179.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -75.4 135.41 18.33 Favored 'Trans proline' 0 C--N 1.304 -1.767 0 C-N-CA 122.863 2.375 . . . . 0.0 112.153 178.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 18.6 ttm180 -65.27 146.3 55.12 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.176 -0.953 . . . . 0.0 109.527 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 91.8 mtm-85 -136.13 -29.91 0.98 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.224 -0.922 . . . . 0.0 109.503 -178.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 34.8 t -131.64 87.64 2.48 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.199 -0.938 . . . . 0.0 109.488 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -177.72 160.64 27.32 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.56 -1.416 . . . . 0.0 109.56 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.406 ' C ' ' H ' ' A' ' 30' ' ' ALA . 97.2 mt -64.66 -42.96 95.03 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.217 -1.166 . . . . 0.0 109.476 -179.642 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.518 ' O ' ' O ' ' A' ' 30' ' ' ALA . 2.0 m -70.76 6.9 1.28 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.251 -0.906 . . . . 0.0 109.48 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.518 ' O ' ' O ' ' A' ' 29' ' ' SER . . . -34.92 155.21 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.194 -0.941 . . . . 0.0 109.49 179.157 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 100.29 -37.54 3.52 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 -179.47 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 73.9 m80 -89.55 166.12 13.85 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.201 -1.176 . . . . 0.0 109.477 179.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 17.2 ptp180 -117.7 134.59 54.74 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.214 -0.929 . . . . 0.0 109.486 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -105.2 141.88 35.95 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.281 -0.887 . . . . 0.0 109.45 -179.057 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 43.6 t -109.76 135.71 47.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.236 -0.915 . . . . 0.0 109.414 179.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 55.3 m-85 -121.96 144.18 49.03 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.17 -0.956 . . . . 0.0 109.49 -179.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.582 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 54.6 m-85 -115.68 147.89 40.34 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.284 -0.885 . . . . 0.0 109.475 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 36.4 m-85 -127.25 141.04 51.82 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.297 -0.877 . . . . 0.0 109.456 -179.524 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.458 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.4 OUTLIER -98.86 177.64 1.52 Allowed Pre-proline 0 N--CA 1.49 1.553 0 O-C-N 121.375 -0.828 . . . . 0.0 109.397 179.448 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.458 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 53.0 Cg_exo -54.36 -34.67 81.57 Favored 'Trans proline' 0 C--N 1.305 -1.726 0 C-N-CA 122.861 2.374 . . . . 0.0 112.322 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 46.6 t -85.8 1.16 50.8 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.298 -0.876 . . . . 0.0 109.468 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 85.41 15.86 65.5 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 81.9 tttt -66.52 121.54 15.57 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.189 -1.183 . . . . 0.0 109.514 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 62.4 tttm -92.77 124.85 37.07 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.206 -0.933 . . . . 0.0 109.506 179.612 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.553 ' N ' ' CD1' ' A' ' 45' ' ' PHE . 2.3 p90 -139.88 146.12 38.89 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.264 -0.898 . . . . 0.0 109.455 -179.721 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 14.9 ptm180 -136.64 59.57 1.69 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.233 -0.917 . . . . 0.0 109.493 179.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.7 p -153.35 137.65 16.6 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.324 -0.86 . . . . 0.0 109.476 179.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.607 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 0.9 OUTLIER -66.52 -46.23 58.34 Favored Pre-proline 0 N--CA 1.489 1.499 0 O-C-N 121.314 -0.866 . . . . 0.0 109.503 -179.298 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.607 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 44.3 Cg_exo -55.83 -48.88 17.71 Favored 'Trans proline' 0 C--N 1.305 -1.738 0 C-N-CA 122.855 2.37 . . . . 0.0 112.261 -178.817 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.475 HE21 ' HB2' ' A' ' 45' ' ' PHE . 17.6 tt0 -65.76 -37.42 86.29 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.229 -0.919 . . . . 0.0 109.502 -179.833 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 44.5 tp -65.75 -47.57 74.78 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.286 -0.883 . . . . 0.0 109.553 -179.31 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.648 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -67.01 -45.55 77.23 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.324 -0.86 . . . . 0.0 109.51 -179.58 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 62.6 ttp180 -60.68 -45.54 93.75 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.173 -0.954 . . . . 0.0 109.514 -179.637 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 25.5 t80 -63.08 -52.57 62.2 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.301 -0.874 . . . . 0.0 109.479 -179.066 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.708 HD21 ' CZ2' ' A' ' 17' ' ' TRP . 98.0 mt -88.7 3.98 48.87 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.21 -0.931 . . . . 0.0 109.447 -179.922 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.648 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -61.89 -39.66 97.81 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.49 -1.444 . . . . 0.0 109.49 -179.621 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -83.23 2.35 87.19 Favored Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.51 -1.436 . . . . 0.0 109.51 -179.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 79.3 p -119.13 -23.31 6.86 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.326 -1.103 . . . . 0.0 109.457 -179.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 8.3 ttm -176.49 168.99 2.68 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.29 -0.881 . . . . 0.0 109.459 -179.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.517 ' C ' HD22 ' A' ' 61' ' ' LEU . 93.5 m-20 -96.39 114.57 26.26 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.226 -0.921 . . . . 0.0 109.5 179.382 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.567 ' N ' HD22 ' A' ' 61' ' ' LEU . 3.6 mm? -98.31 4.69 48.68 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.231 -0.918 . . . . 0.0 109.49 -179.404 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 77.5 p -58.03 -38.26 75.9 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.252 -0.905 . . . . 0.0 109.46 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 19.6 p -87.56 6.21 35.5 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.269 -0.894 . . . . 0.0 109.463 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.416 ' CZ ' ' HA2' ' A' ' 69' ' ' GLY . 55.6 t80 -91.88 122.88 34.82 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.22 -0.925 . . . . 0.0 109.448 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.451 ' O ' ' N ' ' A' ' 69' ' ' GLY . 97.5 m-20 -75.35 114.38 13.82 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.25 -0.906 . . . . 0.0 109.493 179.805 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.582 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 81.9 t80 -77.76 -41.03 38.98 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.227 -0.921 . . . . 0.0 109.497 -179.378 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -61.56 -45.12 95.5 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.198 -0.939 . . . . 0.0 109.459 -179.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 46.0 p -95.06 -15.53 23.37 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.229 -0.919 . . . . 0.0 109.499 -179.505 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.451 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 63.92 44.64 95.75 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.57 -1.412 . . . . 0.0 109.57 -179.683 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 64.8 mttp -142.22 158.27 43.92 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.224 -1.163 . . . . 0.0 109.444 -179.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 1.2 mmt -79.69 136.81 36.88 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.232 -0.917 . . . . 0.0 109.435 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.43 HD12 ' HA ' ' A' ' 72' ' ' LEU . 48.9 tp . . . . . 0 N--CA 1.489 1.496 0 O-C-N 121.177 -0.952 . . . . 0.0 109.499 -179.712 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.529 4.867 0 N-CA-C 119.443 2.537 . . . . 0.0 119.443 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 35.4 t -62.65 -43.4 98.91 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.211 -1.17 . . . . 0.0 109.471 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 2.2 tpp -129.91 80.24 1.95 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.204 -0.935 . . . . 0.0 109.444 -179.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -95.89 132.83 40.77 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.256 -0.903 . . . . 0.0 109.524 179.457 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 95.3 mtt-85 -89.92 128.54 36.23 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.288 -0.882 . . . . 0.0 109.424 -179.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 73.6 mttt -72.98 153.7 40.83 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.288 -0.883 . . . . 0.0 109.445 179.844 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.584 ' O ' ' CD1' ' A' ' 8' ' ' TRP . 51.4 ptt85 -149.37 140.88 23.36 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.181 -0.949 . . . . 0.0 109.506 -179.309 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.584 ' CD1' ' O ' ' A' ' 7' ' ' ARG . 7.0 m0 -147.95 129.16 14.67 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.264 -0.897 . . . . 0.0 109.513 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -99.63 127.36 45.73 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.306 -0.871 . . . . 0.0 109.458 179.523 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.475 ' HB3' ' HE ' ' A' ' 19' ' ' ARG . 4.7 t -103.47 134.79 19.56 Favored Pre-proline 0 N--CA 1.491 1.619 0 O-C-N 121.277 -0.89 . . . . 0.0 109.414 -179.629 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -69.54 -14.07 36.22 Favored 'Trans proline' 0 C--N 1.306 -1.696 0 C-N-CA 122.861 2.374 . . . . 0.0 112.194 -179.677 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.458 ' C ' HD22 ' A' ' 13' ' ' LEU . . . -69.39 -34.68 74.88 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.174 -0.954 . . . . 0.0 109.462 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.661 HD22 ' N ' ' A' ' 13' ' ' LEU . 2.6 mm? -91.02 150.47 41.84 Favored Pre-proline 0 N--CA 1.489 1.523 0 O-C-N 121.18 -0.95 . . . . 0.0 109.437 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.402 ' HG2' ' CD1' ' A' ' 17' ' ' TRP . 28.3 Cg_endo -63.94 156.98 55.2 Favored 'Trans proline' 0 C--N 1.305 -1.725 0 C-N-CA 122.748 2.298 . . . . 0.0 112.219 -179.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 55.7 tt0 -53.29 128.02 26.72 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.227 -0.921 . . . . 0.0 109.451 -179.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 124.82 -23.64 6.21 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.589 -1.404 . . . . 0.0 109.589 179.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . 0.448 ' CH2' ' CD2' ' A' ' 55' ' ' LEU . 49.9 m95 -87.64 143.66 27.07 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.294 -1.121 . . . . 0.0 109.406 179.708 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -143.55 156.7 44.68 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.27 -0.894 . . . . 0.0 109.515 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.532 HH21 HD23 ' A' ' 13' ' ' LEU . 53.0 mtt-85 -129.38 129.44 44.75 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.292 -0.88 . . . . 0.0 109.447 179.038 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -134.04 140.43 46.66 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.273 -0.892 . . . . 0.0 109.515 -179.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -104.57 149.05 25.84 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.246 -0.909 . . . . 0.0 109.428 178.595 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 4.7 t -145.84 124.76 6.61 Favored Pre-proline 0 N--CA 1.491 1.625 0 O-C-N 121.209 -0.932 . . . . 0.0 109.598 -179.43 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -75.32 136.47 19.8 Favored 'Trans proline' 0 C--N 1.304 -1.784 0 C-N-CA 122.849 2.366 . . . . 0.0 112.133 179.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 6.4 tpt180 -62.92 147.02 51.61 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.248 -0.907 . . . . 0.0 109.496 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 73.1 ttt-85 -135.01 -33.82 0.9 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.276 -0.89 . . . . 0.0 109.519 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 76.4 p -136.52 104.34 5.54 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.23 -0.919 . . . . 0.0 109.486 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 173.32 172.33 38.72 Favored Glycine 0 N--CA 1.489 2.219 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 58.2 tp -63.78 -42.52 97.75 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.259 -1.142 . . . . 0.0 109.471 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.476 ' O ' ' C ' ' A' ' 30' ' ' ALA . 99.2 p -84.21 10.92 9.12 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.282 -0.886 . . . . 0.0 109.481 -179.515 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.476 ' C ' ' O ' ' A' ' 29' ' ' SER . . . -38.94 131.37 1.39 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.308 -0.87 . . . . 0.0 109.497 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 122.83 -40.3 2.05 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 80.4 m80 -81.66 174.56 11.26 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.341 -1.094 . . . . 0.0 109.451 179.425 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 88.0 mtm-85 -118.94 136.68 53.95 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.175 -0.953 . . . . 0.0 109.492 179.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 93.4 m-20 -116.61 141.31 48.36 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.278 -0.889 . . . . 0.0 109.444 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.6 t -105.19 132.79 51.16 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.26 -0.9 . . . . 0.0 109.435 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -120.76 143.3 48.88 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.223 -0.923 . . . . 0.0 109.51 179.621 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 50.6 m-85 -118.63 146.64 44.5 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.209 -0.932 . . . . 0.0 109.437 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -127.71 138.36 52.77 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.241 -0.912 . . . . 0.0 109.552 -179.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.498 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.4 OUTLIER -99.85 179.32 1.06 Allowed Pre-proline 0 N--CA 1.49 1.545 0 O-C-N 121.194 -0.941 . . . . 0.0 109.504 179.147 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.498 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 40.2 Cg_exo -56.43 -32.59 89.54 Favored 'Trans proline' 0 C--N 1.305 -1.76 0 C-N-CA 122.81 2.34 . . . . 0.0 112.289 -179.628 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 7.4 m -87.08 5.13 39.16 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.369 -0.832 . . . . 0.0 109.594 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 81.43 10.07 85.03 Favored Glycine 0 N--CA 1.49 2.234 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 64.9 tttp -62.89 119.43 9.37 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.238 -1.154 . . . . 0.0 109.492 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.97 123.33 39.52 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.217 -0.927 . . . . 0.0 109.429 179.045 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 41.8 p90 -141.02 147.05 38.05 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.239 -0.913 . . . . 0.0 109.493 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 44.7 ptt85 -130.6 56.05 1.79 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.253 -0.904 . . . . 0.0 109.51 179.499 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -159.33 146.77 17.19 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.193 -0.942 . . . . 0.0 109.522 -179.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.655 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 0.5 OUTLIER -68.87 -42.87 25.38 Favored Pre-proline 0 N--CA 1.49 1.562 0 O-C-N 121.207 -0.933 . . . . 0.0 109.504 -179.581 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.655 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 51.0 Cg_exo -55.01 -44.63 47.81 Favored 'Trans proline' 0 C--N 1.306 -1.686 0 C-N-CA 122.761 2.307 . . . . 0.0 112.231 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 18.2 mm100 -71.32 -37.0 71.79 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.229 -0.919 . . . . 0.0 109.445 179.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.722 HD23 ' O ' ' A' ' 51' ' ' LEU . 3.8 tt -63.44 -47.36 82.21 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.263 -0.898 . . . . 0.0 109.502 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -66.15 -41.91 89.74 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.182 -0.949 . . . . 0.0 109.497 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 77.7 ttt-85 -56.45 -45.39 80.86 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.223 -0.923 . . . . 0.0 109.511 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -66.24 -50.0 65.27 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.325 -0.86 . . . . 0.0 109.455 179.284 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.448 ' CD2' ' CH2' ' A' ' 17' ' ' TRP . 4.2 mm? -70.9 -3.32 18.62 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.199 -0.938 . . . . 0.0 109.415 179.704 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.711 ' O ' ' N ' ' A' ' 58' ' ' SER . . . -50.87 161.68 1.28 Allowed Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.534 -1.426 . . . . 0.0 109.534 179.771 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 59.38 -61.04 0.01 OUTLIER Glycine 0 N--CA 1.489 2.226 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 -179.529 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.711 ' N ' ' O ' ' A' ' 56' ' ' GLY . 80.7 p -60.88 -28.96 69.27 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.273 -1.133 . . . . 0.0 109.463 -178.761 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.429 ' CB ' ' O ' ' A' ' 58' ' ' SER . 2.8 mtp 169.45 126.88 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.219 -0.926 . . . . 0.0 109.452 -179.479 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.794 ' O ' HD12 ' A' ' 61' ' ' LEU . 62.0 t0 -70.62 151.74 44.66 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.313 -0.867 . . . . 0.0 109.424 179.312 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.794 HD12 ' O ' ' A' ' 60' ' ' ASP . 3.7 mp -133.19 24.87 4.2 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.273 -0.892 . . . . 0.0 109.494 -179.04 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 58.0 m -52.61 -32.68 42.85 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.148 -0.97 . . . . 0.0 109.484 -179.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . 0.509 ' O ' ' SD ' ' A' ' 71' ' ' MET . 19.8 p -94.71 35.14 1.26 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.227 -0.92 . . . . 0.0 109.481 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 93.1 t80 -99.05 129.06 45.3 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.259 -0.901 . . . . 0.0 109.455 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 91.7 m-20 -81.9 114.29 20.41 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.253 -0.904 . . . . 0.0 109.375 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -76.45 -41.13 48.47 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.305 -0.872 . . . . 0.0 109.476 -179.549 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 23.1 mmm180 -63.24 -36.34 83.35 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.312 -0.868 . . . . 0.0 109.444 -178.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 19.5 p -95.53 -16.04 22.45 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.299 -0.875 . . . . 0.0 109.476 -179.414 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 64.64 36.48 93.19 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.571 -1.412 . . . . 0.0 109.571 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.8 mtmp? -145.87 162.52 37.54 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.355 -1.085 . . . . 0.0 109.439 -179.573 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.509 ' SD ' ' O ' ' A' ' 63' ' ' THR . 9.6 tpp -80.84 128.33 33.54 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.235 -0.916 . . . . 0.0 109.534 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.537 ' C ' HD23 ' A' ' 72' ' ' LEU . 3.5 tt . . . . . 0 N--CA 1.491 1.605 0 O-C-N 121.336 -0.852 . . . . 0.0 109.472 -179.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.53 4.962 0 N-CA-C 119.442 2.537 . . . . 0.0 119.442 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 50.24 93.32 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.312 -1.111 . . . . 0.0 109.519 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 97.4 mtp -83.03 131.77 35.16 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.182 -0.949 . . . . 0.0 109.495 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.504 ' O ' ' O ' ' A' ' 5' ' ' ARG . 96.0 mt-10 -79.74 -170.84 2.57 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.23 -0.919 . . . . 0.0 109.451 179.625 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.504 ' O ' ' O ' ' A' ' 4' ' ' GLU . 84.5 mtp180 55.17 110.9 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.207 -0.933 . . . . 0.0 109.422 -179.802 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.405 ' O ' ' HA ' ' A' ' 20' ' ' GLU . 26.3 mmtp -109.49 101.0 9.99 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.234 -0.916 . . . . 0.0 109.495 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 41.1 ttm180 -98.35 118.69 35.56 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.225 -0.922 . . . . 0.0 109.392 -179.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.555 ' CD1' ' N ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -132.53 152.03 51.71 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.239 -0.913 . . . . 0.0 109.503 179.284 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 79.3 tt0 -90.91 141.78 28.46 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.301 -0.874 . . . . 0.0 109.473 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -108.25 159.49 30.48 Favored Pre-proline 0 N--CA 1.49 1.533 0 O-C-N 121.336 -0.853 . . . . 0.0 109.454 179.841 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -65.05 -20.62 63.72 Favored 'Trans proline' 0 C--N 1.304 -1.764 0 C-N-CA 122.855 2.37 . . . . 0.0 112.237 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.566 ' HB3' ' CE1' ' A' ' 64' ' ' PHE . . . -93.29 -4.92 50.88 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.165 -0.959 . . . . 0.0 109.473 179.723 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.507 HD23 ' CA ' ' A' ' 18' ' ' GLU . 8.7 mp -98.95 113.41 64.54 Favored Pre-proline 0 N--CA 1.491 1.601 0 O-C-N 121.184 -0.948 . . . . 0.0 109.46 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.731 ' HG2' HD11 ' A' ' 55' ' ' LEU . 49.1 Cg_exo -50.75 155.51 5.5 Favored 'Trans proline' 0 C--N 1.306 -1.707 0 C-N-CA 122.756 2.304 . . . . 0.0 112.261 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -49.93 106.8 0.13 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.305 -0.872 . . . . 0.0 109.523 179.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 125.89 -25.23 5.59 Favored Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.621 -1.392 . . . . 0.0 109.621 179.171 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . 0.436 ' CE2' ' HD3' ' A' ' 40' ' ' PRO . 47.6 m95 -92.86 139.7 30.27 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.302 -1.116 . . . . 0.0 109.467 178.385 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.507 ' CA ' HD23 ' A' ' 13' ' ' LEU . 96.3 mt-10 -151.73 166.19 32.07 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.211 -0.93 . . . . 0.0 109.501 -178.665 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.511 ' NH1' ' OH ' ' A' ' 37' ' ' TYR . 12.1 ptm180 -140.92 145.86 36.64 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.27 -0.894 . . . . 0.0 109.384 178.887 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.405 ' HA ' ' O ' ' A' ' 6' ' ' LYS . 12.2 pt-20 -132.92 145.98 51.39 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.239 -0.913 . . . . 0.0 109.462 -179.117 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 79.7 tt0 -100.01 136.67 39.55 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.271 -0.893 . . . . 0.0 109.452 178.684 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.5 t -135.4 133.71 20.67 Favored Pre-proline 0 N--CA 1.49 1.566 0 O-C-N 121.158 -0.964 . . . . 0.0 109.584 -178.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.423 ' O ' ' N ' ' A' ' 25' ' ' ARG . 50.3 Cg_exo -50.11 150.86 9.75 Favored 'Trans proline' 0 C--N 1.304 -1.779 0 C-N-CA 122.821 2.347 . . . . 0.0 112.099 178.296 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.433 ' HD3' ' N ' ' A' ' 31' ' ' GLY . 0.0 OUTLIER -57.38 90.13 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.201 -0.937 . . . . 0.0 109.44 -179.648 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.423 ' N ' ' O ' ' A' ' 23' ' ' PRO . 97.0 mtt180 -56.25 -75.18 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.286 -0.884 . . . . 0.0 109.405 178.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 30.9 t -162.37 58.57 0.23 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.277 -0.89 . . . . 0.0 109.464 179.684 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -92.37 172.79 35.05 Favored Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.509 -1.437 . . . . 0.0 109.509 179.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.546 ' N ' HD12 ' A' ' 28' ' ' LEU . 10.9 mp -66.15 -40.66 90.74 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.304 -1.115 . . . . 0.0 109.489 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.545 ' O ' ' O ' ' A' ' 30' ' ' ALA . 92.5 p -97.44 20.44 11.66 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.133 -0.979 . . . . 0.0 109.435 -179.614 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.545 ' O ' ' O ' ' A' ' 29' ' ' SER . . . -42.76 170.62 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.27 -0.894 . . . . 0.0 109.466 179.842 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.433 ' N ' ' HD3' ' A' ' 24' ' ' ARG . . . 124.45 -16.45 7.52 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.488 -1.445 . . . . 0.0 109.488 -179.464 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 56.8 m80 -133.11 -146.06 0.26 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.174 -1.192 . . . . 0.0 109.493 179.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -116.8 134.77 54.38 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.14 -0.975 . . . . 0.0 109.492 179.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.597 ' OD2' ' CE2' ' A' ' 36' ' ' PHE . 9.2 t70 -103.12 140.73 36.94 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.202 -0.936 . . . . 0.0 109.481 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.592 ' O ' ' CD ' ' A' ' 46' ' ' ARG . 97.6 t -119.67 132.12 70.3 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.251 -0.905 . . . . 0.0 109.481 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.597 ' CE2' ' OD2' ' A' ' 34' ' ' ASP . 94.5 m-85 -116.2 150.89 36.76 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.221 -0.925 . . . . 0.0 109.542 -179.674 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.596 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 23.2 m-85 -112.69 147.15 37.39 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.257 -0.902 . . . . 0.0 109.463 179.737 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -126.39 139.44 53.27 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.214 -0.929 . . . . 0.0 109.552 -179.502 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -102.23 174.57 2.78 Favored Pre-proline 0 N--CA 1.489 1.51 0 O-C-N 121.251 -0.906 . . . . 0.0 109.419 179.33 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.436 ' HD3' ' CE2' ' A' ' 17' ' ' TRP . 52.8 Cg_exo -52.79 -35.95 71.59 Favored 'Trans proline' 0 C--N 1.306 -1.699 0 C-N-CA 122.85 2.367 . . . . 0.0 112.225 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 4.2 m -82.48 -1.01 49.02 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.342 -0.848 . . . . 0.0 109.476 -179.639 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 87.15 11.93 68.82 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -70.04 116.14 10.06 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.259 -1.142 . . . . 0.0 109.494 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 20.0 pttp -94.92 132.59 39.58 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.13 -0.981 . . . . 0.0 109.5 178.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.443 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 8.5 p90 -141.68 151.8 43.32 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.324 -0.86 . . . . 0.0 109.49 -179.776 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.592 ' CD ' ' O ' ' A' ' 35' ' ' VAL . 24.1 tpt85 -125.26 63.39 1.17 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.175 -0.953 . . . . 0.0 109.494 179.29 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.0 t -150.84 125.66 9.74 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.24 -0.913 . . . . 0.0 109.42 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.716 ' N ' ' HD2' ' A' ' 49' ' ' PRO . 20.1 tttt -65.21 -53.47 40.04 Favored Pre-proline 0 N--CA 1.489 1.48 0 O-C-N 121.233 -0.917 . . . . 0.0 109.506 -179.598 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.716 ' HD2' ' N ' ' A' ' 48' ' ' LYS . 14.5 Cg_endo -56.56 -38.69 94.95 Favored 'Trans proline' 0 C--N 1.304 -1.765 0 C-N-CA 122.877 2.385 . . . . 0.0 112.148 179.19 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -65.5 -35.22 80.23 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.344 -0.848 . . . . 0.0 109.432 179.152 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.807 HD23 ' O ' ' A' ' 51' ' ' LEU . 4.4 tt -68.54 -42.54 78.28 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.277 -0.89 . . . . 0.0 109.491 179.647 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.591 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -62.55 -41.28 98.8 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.268 -0.895 . . . . 0.0 109.463 -179.813 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 71.7 ttp85 -59.5 -48.66 80.79 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.175 -0.953 . . . . 0.0 109.457 179.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 6.2 t80 -63.79 -49.08 74.33 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.268 -0.895 . . . . 0.0 109.524 179.431 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.731 HD11 ' HG2' ' A' ' 14' ' ' PRO . 3.3 mm? -81.34 -0.72 42.42 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.161 -0.962 . . . . 0.0 109.451 179.672 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.591 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -62.07 -35.15 91.05 Favored Glycine 0 N--CA 1.489 2.218 0 N-CA-C 109.604 -1.399 . . . . 0.0 109.604 -179.584 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -88.64 -3.12 78.02 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.459 -1.456 . . . . 0.0 109.459 -179.32 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -112.34 -30.7 7.08 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.308 -1.113 . . . . 0.0 109.494 -179.574 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.437 ' O ' ' O ' ' A' ' 55' ' ' LEU . 31.2 ttp -174.58 167.25 3.86 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.286 -0.884 . . . . 0.0 109.471 -179.771 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.544 ' C ' HD12 ' A' ' 61' ' ' LEU . 93.7 m-20 -92.52 113.36 25.61 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.196 -0.94 . . . . 0.0 109.518 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.544 HD12 ' C ' ' A' ' 60' ' ' ASP . 11.1 mp -111.61 9.54 21.11 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.246 -0.909 . . . . 0.0 109.505 -179.803 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 88.5 p -55.78 -34.8 65.59 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.286 -0.884 . . . . 0.0 109.541 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 10.4 p -91.83 24.86 2.98 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.281 -0.887 . . . . 0.0 109.445 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.566 ' CE1' ' HB3' ' A' ' 12' ' ' ALA . 79.9 t80 -91.41 126.18 36.41 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.103 -0.998 . . . . 0.0 109.438 -179.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.552 ' O ' ' N ' ' A' ' 69' ' ' GLY . 96.5 m-20 -75.84 111.77 11.54 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.211 -0.93 . . . . 0.0 109.513 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.596 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 66.1 t80 -74.29 -45.01 50.36 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.236 -0.915 . . . . 0.0 109.49 -179.385 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 24.6 mmm180 -63.88 -37.9 89.11 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.2 -0.938 . . . . 0.0 109.471 -178.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.402 ' OG1' ' CB ' ' A' ' 65' ' ' ASP . 5.6 p -98.9 -15.26 19.24 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.297 -0.877 . . . . 0.0 109.538 -179.376 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.552 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 62.3 39.11 97.3 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.634 -1.386 . . . . 0.0 109.634 -179.842 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.456 ' H ' ' HB2' ' A' ' 65' ' ' ASP . 71.7 mmtt -133.42 151.59 51.82 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.216 -1.167 . . . . 0.0 109.413 -179.407 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 6.6 ttm -96.01 124.44 40.02 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.201 -0.937 . . . . 0.0 109.381 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 58.0 tp . . . . . 0 N--CA 1.491 1.614 0 O-C-N 121.274 -0.891 . . . . 0.0 109.428 -179.709 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.452 ' O ' ' C ' ' A' ' 2' ' ' SER . . . . . . . . 1 N--CA 1.531 4.984 0 N-CA-C 119.381 2.512 . . . . 0.0 119.381 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.452 ' C ' ' O ' ' A' ' 1' ' ' GLY . 1.0 OUTLIER 41.27 35.04 0.37 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.245 -1.15 . . . . 0.0 109.413 179.991 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 67.0 mtt -82.39 142.31 32.07 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.282 -0.886 . . . . 0.0 109.41 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 82.9 tt0 -95.98 127.52 42.07 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.231 -0.918 . . . . 0.0 109.525 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 89.7 mtm180 -75.35 143.41 42.87 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.326 -0.859 . . . . 0.0 109.477 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.434 ' HD3' ' H ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -72.06 154.86 40.87 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.326 -0.859 . . . . 0.0 109.49 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 62.7 ttp180 -153.3 144.62 23.14 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.229 -0.92 . . . . 0.0 109.388 -179.495 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.627 ' N ' ' CD1' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -166.1 139.48 4.18 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.15 -0.969 . . . . 0.0 109.536 -179.331 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -105.8 117.68 34.65 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.179 -0.951 . . . . 0.0 109.472 178.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.654 ' N ' HH12 ' A' ' 19' ' ' ARG . 10.1 p -92.37 137.45 24.64 Favored Pre-proline 0 N--CA 1.491 1.608 0 O-C-N 121.319 -0.863 . . . . 0.0 109.416 -178.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -69.89 -16.69 37.09 Favored 'Trans proline' 0 C--N 1.304 -1.794 0 C-N-CA 122.783 2.322 . . . . 0.0 112.262 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.492 ' C ' HD22 ' A' ' 13' ' ' LEU . . . -60.22 -31.76 70.47 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.297 -0.877 . . . . 0.0 109.484 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.626 HD22 ' N ' ' A' ' 13' ' ' LEU . 3.7 mm? -95.39 154.44 39.37 Favored Pre-proline 0 N--CA 1.491 1.604 0 O-C-N 121.346 -0.846 . . . . 0.0 109.477 179.825 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -55.42 144.13 74.19 Favored 'Trans proline' 0 C--N 1.306 -1.704 0 C-N-CA 122.798 2.332 . . . . 0.0 112.165 179.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -49.18 129.15 17.72 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.268 -0.895 . . . . 0.0 109.485 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 118.04 -19.89 10.86 Favored Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.594 -1.403 . . . . 0.0 109.594 -179.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . 0.406 ' CZ2' HD11 ' A' ' 55' ' ' LEU . 20.7 m95 -85.09 144.09 28.45 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.232 -1.158 . . . . 0.0 109.45 -179.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -144.63 157.06 44.37 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.253 -0.904 . . . . 0.0 109.477 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.654 HH12 ' N ' ' A' ' 10' ' ' CYS . 32.8 ptt-85 -147.25 152.54 38.48 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.179 -0.951 . . . . 0.0 109.381 179.502 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.401 ' O ' ' CD ' ' A' ' 20' ' ' GLU . 0.0 OUTLIER -150.61 151.0 31.89 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.28 -0.888 . . . . 0.0 109.526 -179.499 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.425 ' OE1' ' CE ' ' A' ' 6' ' ' LYS . 86.4 tt0 -96.57 146.06 25.16 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.268 -0.895 . . . . 0.0 109.326 179.184 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.8 t -144.43 122.79 6.82 Favored Pre-proline 0 N--CA 1.49 1.554 0 O-C-N 121.245 -0.909 . . . . 0.0 109.523 -178.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -75.76 136.51 18.99 Favored 'Trans proline' 0 C--N 1.306 -1.693 0 C-N-CA 122.828 2.352 . . . . 0.0 112.214 179.451 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 95.1 mtt-85 -64.64 148.46 50.89 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.18 -0.95 . . . . 0.0 109.534 -179.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 91.1 mtm-85 -132.18 -28.42 1.72 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.271 -0.893 . . . . 0.0 109.524 -179.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 46.8 t -138.11 97.16 3.33 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.195 -0.941 . . . . 0.0 109.493 179.705 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 176.18 165.57 32.14 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.595 -1.402 . . . . 0.0 109.595 -179.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.676 ' CD2' ' H ' ' A' ' 28' ' ' LEU . 0.1 OUTLIER -68.04 -45.06 75.0 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.288 -1.125 . . . . 0.0 109.447 -179.805 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.557 ' O ' ' C ' ' A' ' 30' ' ' ALA . 4.6 m -71.56 3.88 3.56 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.273 -0.892 . . . . 0.0 109.408 -179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.557 ' C ' ' O ' ' A' ' 29' ' ' SER . . . -34.22 152.64 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.257 -0.902 . . . . 0.0 109.54 179.373 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 102.54 -36.6 4.18 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 37.7 m80 -87.15 168.35 13.33 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.23 -1.159 . . . . 0.0 109.461 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.39 139.49 52.73 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.234 -0.916 . . . . 0.0 109.385 -179.837 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.564 ' OD1' ' N ' ' A' ' 35' ' ' VAL . 67.3 t0 -119.37 142.01 48.54 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.269 -0.894 . . . . 0.0 109.455 -179.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.564 ' N ' ' OD1' ' A' ' 34' ' ' ASP . 62.7 t -110.58 140.82 27.99 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.246 -0.909 . . . . 0.0 109.397 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 65.0 m-85 -122.52 149.98 43.19 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.245 -0.91 . . . . 0.0 109.498 -179.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.562 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 22.3 m-85 -116.58 145.22 43.53 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.289 -0.882 . . . . 0.0 109.408 -179.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -120.5 134.87 55.22 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.209 -0.932 . . . . 0.0 109.445 -179.369 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.503 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -97.6 -179.56 0.9 Allowed Pre-proline 0 N--CA 1.491 1.586 0 O-C-N 121.301 -0.875 . . . . 0.0 109.358 179.221 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.503 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 39.2 Cg_exo -56.86 -28.97 79.69 Favored 'Trans proline' 0 C--N 1.306 -1.671 0 C-N-CA 122.836 2.357 . . . . 0.0 112.151 -179.633 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 94.1 p -91.44 2.48 56.38 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.261 -0.899 . . . . 0.0 109.518 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 83.45 14.78 72.95 Favored Glycine 0 N--CA 1.49 2.243 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 179.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -70.91 123.98 23.28 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.293 -1.122 . . . . 0.0 109.404 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.675 ' NZ ' HH22 ' A' ' 46' ' ' ARG . 18.6 pttp -95.32 129.6 42.4 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.216 -0.927 . . . . 0.0 109.48 179.202 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.659 ' N ' ' CD1' ' A' ' 45' ' ' PHE . 0.7 OUTLIER -140.52 147.85 40.16 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.316 -0.865 . . . . 0.0 109.431 -179.837 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.675 HH22 ' NZ ' ' A' ' 44' ' ' LYS . 6.2 ptp85 -134.06 57.43 1.81 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.288 -0.882 . . . . 0.0 109.466 179.664 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -150.73 132.48 14.97 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.217 -0.927 . . . . 0.0 109.524 -179.78 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.722 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 2.7 tmtm? -71.25 -39.37 7.9 Favored Pre-proline 0 N--CA 1.491 1.593 0 O-C-N 121.319 -0.863 . . . . 0.0 109.488 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.722 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 33.0 Cg_exo -57.6 -55.17 2.61 Favored 'Trans proline' 0 C--N 1.306 -1.699 0 C-N-CA 122.894 2.396 . . . . 0.0 112.181 -179.556 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 26.7 tt0 -69.34 -31.83 70.53 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.274 -0.891 . . . . 0.0 109.474 179.437 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.754 ' C ' HD23 ' A' ' 51' ' ' LEU . 6.6 tt -67.78 -51.79 44.78 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.271 -0.893 . . . . 0.0 109.525 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.678 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -65.11 -42.74 93.7 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.163 -0.96 . . . . 0.0 109.511 179.885 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 80.3 mmt-85 -62.48 -37.89 87.71 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.269 -0.894 . . . . 0.0 109.521 -179.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 33.2 t80 -59.75 -51.66 68.8 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.313 -0.867 . . . . 0.0 109.445 -179.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.427 ' C ' ' N ' ' A' ' 57' ' ' GLY . 79.0 mt -100.3 5.63 44.54 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.24 -0.913 . . . . 0.0 109.517 179.683 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.678 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -52.72 -10.94 1.11 Allowed Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 -179.202 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . 0.427 ' N ' ' C ' ' A' ' 55' ' ' LEU . . . -106.22 -50.12 0.89 Allowed Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.556 -1.417 . . . . 0.0 109.556 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 95.1 p -63.64 -24.25 67.71 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.288 -1.125 . . . . 0.0 109.531 -179.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 2.1 mmm -169.77 163.42 9.83 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.23 -0.919 . . . . 0.0 109.405 -179.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 49.7 t0 -95.37 114.89 26.71 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.222 -0.924 . . . . 0.0 109.465 179.636 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 95.2 mt -110.61 7.05 22.25 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.227 -0.921 . . . . 0.0 109.467 -179.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 33.4 t -51.93 -32.05 31.38 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.2 -0.938 . . . . 0.0 109.437 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 24.2 p -91.99 14.31 16.15 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.238 -0.914 . . . . 0.0 109.452 -179.499 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.525 ' O ' ' NZ ' ' A' ' 48' ' ' LYS . 84.0 t80 -89.7 123.56 33.83 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.248 -0.908 . . . . 0.0 109.44 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 82.4 m-20 -78.59 124.19 27.9 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.325 -0.86 . . . . 0.0 109.448 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.562 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 77.5 t80 -77.45 -43.18 33.28 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.293 -0.879 . . . . 0.0 109.486 179.445 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.22 -45.39 94.77 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.286 -0.884 . . . . 0.0 109.459 -178.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 76.0 p -92.49 -17.85 23.96 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.274 -0.891 . . . . 0.0 109.5 -179.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 62.85 28.59 72.07 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.504 -1.438 . . . . 0.0 109.504 -179.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 64.4 mttp -125.25 153.49 43.11 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.324 -1.103 . . . . 0.0 109.44 -179.436 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.419 ' HB2' ' HB2' ' A' ' 12' ' ' ALA . 24.7 ttm -90.65 126.43 35.97 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.272 -0.893 . . . . 0.0 109.514 -179.745 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.444 ' C ' HD23 ' A' ' 72' ' ' LEU . 1.6 tt . . . . . 0 N--CA 1.489 1.517 0 O-C-N 121.171 -0.956 . . . . 0.0 109.527 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.6 ' C ' ' H ' ' A' ' 3' ' ' MET . . . . . . . . 1 N--CA 1.529 4.866 0 N-CA-C 119.353 2.501 . . . . 0.0 119.353 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.1 t 67.16 -29.06 0.14 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.242 -1.152 . . . . 0.0 109.531 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.6 ' H ' ' C ' ' A' ' 1' ' ' GLY . 99.3 mmm -81.34 117.55 21.9 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.208 -0.932 . . . . 0.0 109.362 -179.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.602 ' OE1' ' N ' ' A' ' 4' ' ' GLU . 55.8 mp0 -94.11 17.84 11.81 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.293 -0.879 . . . . 0.0 109.47 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.449 ' NE ' ' OE2' ' A' ' 20' ' ' GLU . 79.3 mtp180 -88.41 111.85 22.24 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.278 -0.889 . . . . 0.0 109.421 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.457 ' HB3' ' CH2' ' A' ' 8' ' ' TRP . 59.8 mttt -82.9 168.83 16.69 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.183 -0.948 . . . . 0.0 109.472 -179.303 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.426 ' HG2' ' O ' ' A' ' 6' ' ' LYS . 22.7 mmt180 -146.57 138.01 24.45 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.154 -0.967 . . . . 0.0 109.455 -178.179 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.468 ' HE1' ' HB2' ' A' ' 21' ' ' GLU . 12.4 m95 -123.61 118.16 26.68 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.228 -0.92 . . . . 0.0 109.489 179.088 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 -78.41 148.83 33.47 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.22 -0.925 . . . . 0.0 109.518 178.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.536 ' SG ' ' NE ' ' A' ' 19' ' ' ARG . 20.8 p -135.13 101.5 11.29 Favored Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.155 -0.966 . . . . 0.0 109.494 -179.278 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -73.54 -11.44 24.36 Favored 'Trans proline' 0 C--N 1.305 -1.761 0 C-N-CA 122.836 2.358 . . . . 0.0 112.224 179.227 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.513 ' C ' HD22 ' A' ' 13' ' ' LEU . . . -80.21 -21.14 43.23 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.221 -0.924 . . . . 0.0 109.409 178.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.566 HD22 ' N ' ' A' ' 13' ' ' LEU . 3.3 mm? -98.94 156.78 35.13 Favored Pre-proline 0 N--CA 1.489 1.499 0 O-C-N 121.198 -0.939 . . . . 0.0 109.43 179.544 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -52.79 147.51 31.68 Favored 'Trans proline' 0 C--N 1.305 -1.736 0 C-N-CA 122.838 2.359 . . . . 0.0 112.263 178.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 27.3 mm100 -56.64 125.47 22.39 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.232 -0.917 . . . . 0.0 109.507 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 124.54 -18.9 7.18 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.57 -1.412 . . . . 0.0 109.57 179.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . 0.406 ' HB3' HH21 ' A' ' 19' ' ' ARG . 47.9 m95 -91.21 137.35 32.43 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.237 -1.154 . . . . 0.0 109.441 179.319 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -146.58 162.35 38.57 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.236 -0.915 . . . . 0.0 109.485 -179.151 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.536 ' NE ' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -123.04 160.24 26.73 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.274 -0.892 . . . . 0.0 109.473 178.812 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.449 ' OE2' ' NE ' ' A' ' 5' ' ' ARG . 75.6 tt0 -145.11 134.82 23.45 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.29 -0.881 . . . . 0.0 109.464 -179.082 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.533 ' CD ' HG22 ' A' ' 35' ' ' VAL . 4.0 tp10 -103.95 129.97 51.54 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.21 -0.931 . . . . 0.0 109.35 178.191 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.0 t -134.12 99.21 13.68 Favored Pre-proline 0 N--CA 1.489 1.476 0 O-C-N 121.271 -0.893 . . . . 0.0 109.593 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -58.03 135.19 67.08 Favored 'Trans proline' 0 C--N 1.304 -1.796 0 C-N-CA 122.858 2.372 . . . . 0.0 112.122 178.105 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.427 HH11 ' HD2' ' A' ' 24' ' ' ARG . 20.8 ttm105 -66.72 147.95 52.57 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.231 -0.918 . . . . 0.0 109.464 179.619 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -144.53 -31.44 0.44 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.239 -0.913 . . . . 0.0 109.46 -179.101 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 66.7 m -121.58 -3.05 9.33 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.259 -0.901 . . . . 0.0 109.403 -179.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -74.7 154.6 47.27 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 -179.798 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.433 ' C ' ' H ' ' A' ' 30' ' ' ALA . 56.9 tp -61.73 -40.25 94.43 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.303 -1.116 . . . . 0.0 109.457 179.763 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.553 ' O ' ' C ' ' A' ' 30' ' ' ALA . 4.0 t -77.27 26.33 0.16 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.229 -0.92 . . . . 0.0 109.436 -179.445 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.553 ' C ' ' O ' ' A' ' 29' ' ' SER . . . -33.01 150.71 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.277 -0.889 . . . . 0.0 109.443 179.542 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 104.84 -40.5 2.45 Favored Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 -179.461 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 71.0 m80 -90.62 158.57 16.88 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.241 -1.152 . . . . 0.0 109.447 179.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 37.2 ptt-85 -117.26 138.86 51.45 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.343 -0.848 . . . . 0.0 109.481 179.759 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -100.68 138.45 37.72 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.243 -0.911 . . . . 0.0 109.452 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.533 HG22 ' CD ' ' A' ' 21' ' ' GLU . 37.6 t -110.04 134.62 51.6 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.304 -0.872 . . . . 0.0 109.437 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -119.55 145.06 46.7 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.289 -0.882 . . . . 0.0 109.478 179.586 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.689 ' CE1' ' CZ ' ' A' ' 66' ' ' PHE . 7.7 m-85 -114.84 145.27 42.34 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.267 -0.895 . . . . 0.0 109.4 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -123.68 135.52 53.94 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.34 -0.85 . . . . 0.0 109.608 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.457 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -98.21 177.96 1.46 Allowed Pre-proline 0 N--CA 1.49 1.533 0 O-C-N 121.28 -0.888 . . . . 0.0 109.467 179.325 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.457 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 50.0 Cg_exo -55.08 -32.95 81.83 Favored 'Trans proline' 0 C--N 1.305 -1.731 0 C-N-CA 122.82 2.347 . . . . 0.0 112.339 179.862 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 41.1 t -87.52 4.35 43.87 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.341 -0.849 . . . . 0.0 109.494 -179.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 82.09 16.15 72.86 Favored Glycine 0 N--CA 1.489 2.175 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 -179.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -70.25 119.62 14.71 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.29 -1.123 . . . . 0.0 109.509 179.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.443 ' O ' ' HG3' ' A' ' 44' ' ' LYS . 24.3 pttm -94.8 125.03 39.19 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.235 -0.916 . . . . 0.0 109.494 178.873 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 31.8 p90 -141.48 149.04 40.4 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.214 -0.929 . . . . 0.0 109.557 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 26.5 ptt-85 -133.91 60.78 1.69 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.178 -0.951 . . . . 0.0 109.439 179.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.2 m -155.62 138.83 15.63 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.243 -0.911 . . . . 0.0 109.469 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.606 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 2.3 tttm -65.9 -45.8 64.65 Favored Pre-proline 0 N--CA 1.49 1.536 0 O-C-N 121.245 -0.909 . . . . 0.0 109.41 -179.719 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.606 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 49.0 Cg_exo -54.97 -44.4 50.13 Favored 'Trans proline' 0 C--N 1.306 -1.679 0 C-N-CA 122.84 2.36 . . . . 0.0 112.228 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -67.78 -38.15 83.0 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.236 -0.915 . . . . 0.0 109.444 179.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 55.3 tp -65.87 -45.8 80.77 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.31 -0.869 . . . . 0.0 109.397 -179.329 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.707 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -69.02 -44.56 72.48 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.302 -0.874 . . . . 0.0 109.529 -179.648 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 7.9 tpt180 -60.22 -43.3 96.13 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.267 -0.896 . . . . 0.0 109.456 -179.474 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 25.9 t80 -62.64 -52.86 61.68 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.181 -0.95 . . . . 0.0 109.451 -179.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.406 HD23 ' HA ' ' A' ' 55' ' ' LEU . 97.6 mt -90.9 2.53 56.12 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.271 -0.893 . . . . 0.0 109.464 179.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.707 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -45.06 -78.13 0.08 OUTLIER Glycine 0 N--CA 1.491 2.359 0 N-CA-C 109.471 -1.452 . . . . 0.0 109.471 -179.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.32 7.47 0.22 Allowed Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 -179.564 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.563 ' H ' ' C ' ' A' ' 56' ' ' GLY . 3.0 m -104.19 -27.03 12.29 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.228 -1.16 . . . . 0.0 109.533 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.671 ' SD ' HD11 ' A' ' 61' ' ' LEU . 1.7 ptp 178.1 171.25 0.7 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.253 -0.905 . . . . 0.0 109.48 -179.463 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 59.6 t0 -93.56 111.44 23.11 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.194 -0.942 . . . . 0.0 109.397 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.671 HD11 ' SD ' ' A' ' 59' ' ' MET . 10.7 mp -99.73 5.1 45.71 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.239 -0.913 . . . . 0.0 109.428 -179.921 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 23.4 m -46.16 -38.78 8.68 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.279 -0.888 . . . . 0.0 109.462 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 55.8 p -95.35 49.65 1.21 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.301 -0.874 . . . . 0.0 109.4 179.315 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 65.9 t80 -116.61 132.16 56.76 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.302 -0.874 . . . . 0.0 109.477 -179.576 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 91.8 m-20 -93.42 107.75 19.53 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.188 -0.945 . . . . 0.0 109.544 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.689 ' CZ ' ' CE1' ' A' ' 37' ' ' TYR . 53.2 t80 -75.43 -40.36 57.78 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.339 -0.851 . . . . 0.0 109.465 -179.723 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 27.9 mmt180 -62.05 -32.89 73.45 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.282 -0.886 . . . . 0.0 109.464 -179.592 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 16.1 p -95.22 -15.23 23.4 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.258 -0.901 . . . . 0.0 109.486 -179.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 67.12 27.02 73.34 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.579 -1.408 . . . . 0.0 109.579 -179.608 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -138.19 158.0 45.17 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.198 -1.178 . . . . 0.0 109.47 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.427 ' O ' ' C ' ' A' ' 72' ' ' LEU . 19.9 ttm -91.35 132.76 35.97 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.192 -0.942 . . . . 0.0 109.543 -179.763 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.427 ' C ' ' O ' ' A' ' 71' ' ' MET . 56.1 tp . . . . . 0 N--CA 1.49 1.567 0 O-C-N 121.281 -0.887 . . . . 0.0 109.528 -179.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.528 4.832 0 N-CA-C 119.431 2.532 . . . . 0.0 119.431 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 41.6 t -107.6 153.07 23.42 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.318 -1.107 . . . . 0.0 109.479 -179.775 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 57.1 mtt 53.82 39.85 30.83 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.233 -0.917 . . . . 0.0 109.41 179.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 76.9 mm-40 -98.48 115.14 27.91 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.325 -0.859 . . . . 0.0 109.464 179.517 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 84.0 mtt85 -127.22 132.14 50.49 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.175 -0.953 . . . . 0.0 109.512 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.421 ' HB2' ' CZ3' ' A' ' 8' ' ' TRP . 26.1 mmtp -100.32 98.04 8.74 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.159 -0.963 . . . . 0.0 109.532 179.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.597 HH21 ' CD ' ' A' ' 18' ' ' GLU . 85.2 mtp180 -70.66 166.2 21.28 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.173 -0.954 . . . . 0.0 109.465 -179.405 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.491 ' CG ' ' O ' ' A' ' 7' ' ' ARG . 1.3 m0 -165.8 141.9 5.15 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.235 -0.916 . . . . 0.0 109.542 -179.474 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -111.29 139.59 46.56 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.247 -0.908 . . . . 0.0 109.493 179.256 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.7 t -127.58 140.6 38.49 Favored Pre-proline 0 N--CA 1.49 1.567 0 O-C-N 121.247 -0.908 . . . . 0.0 109.505 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -51.11 -31.79 37.05 Favored 'Trans proline' 0 C--N 1.305 -1.756 0 C-N-CA 122.812 2.342 . . . . 0.0 112.157 179.333 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.407 ' HB2' ' HB2' ' A' ' 71' ' ' MET . . . -76.89 -10.73 59.57 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.164 -0.96 . . . . 0.0 109.462 -179.492 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.6 mp -90.43 116.17 65.79 Favored Pre-proline 0 N--CA 1.49 1.567 0 O-C-N 121.243 -0.911 . . . . 0.0 109.495 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.415 ' O ' ' C ' ' A' ' 15' ' ' GLN . 48.6 Cg_exo -51.04 141.93 35.98 Favored 'Trans proline' 0 C--N 1.305 -1.725 0 C-N-CA 122.832 2.355 . . . . 0.0 112.244 -179.551 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.415 ' C ' ' O ' ' A' ' 14' ' ' PRO . 0.0 OUTLIER -44.64 107.17 0.09 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.249 -0.907 . . . . 0.0 109.523 -179.498 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 127.13 -23.87 5.45 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 178.725 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 24.1 m95 -80.04 139.13 37.07 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.215 -1.168 . . . . 0.0 109.46 178.748 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.597 ' CD ' HH21 ' A' ' 7' ' ' ARG . 97.0 mt-10 -127.95 150.47 49.88 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.248 -0.908 . . . . 0.0 109.432 -178.089 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.402 ' NH1' ' HA3' ' A' ' 69' ' ' GLY . 53.8 ttp180 -128.16 149.89 50.24 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.219 -0.926 . . . . 0.0 109.493 177.807 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 18.8 pt-20 -156.07 141.02 17.25 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.288 -0.883 . . . . 0.0 109.496 -179.226 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 79.6 tt0 -98.49 133.04 43.41 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.229 -0.919 . . . . 0.0 109.352 178.458 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.6 t -139.78 103.46 6.95 Favored Pre-proline 0 N--CA 1.49 1.559 0 O-C-N 121.182 -0.948 . . . . 0.0 109.533 -178.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.416 ' HA ' ' HA ' ' A' ' 33' ' ' ARG . 47.1 Cg_exo -55.38 129.34 34.67 Favored 'Trans proline' 0 C--N 1.305 -1.715 0 C-N-CA 122.881 2.387 . . . . 0.0 112.203 178.685 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -59.26 141.18 54.99 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.203 -0.936 . . . . 0.0 109.476 179.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.572 ' O ' ' O ' ' A' ' 26' ' ' SER . 27.1 mmt180 -121.53 5.34 10.11 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.286 -0.884 . . . . 0.0 109.462 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.572 ' O ' ' O ' ' A' ' 25' ' ' ARG . 47.5 t -34.41 -94.54 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.347 -0.846 . . . . 0.0 109.467 -179.591 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -155.67 -92.53 0.09 OUTLIER Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.525 -1.43 . . . . 0.0 109.525 -179.787 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.4 tt -65.67 -44.1 87.29 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.287 -1.125 . . . . 0.0 109.436 -179.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.497 ' O ' ' C ' ' A' ' 30' ' ' ALA . 6.2 m -74.16 -20.64 60.16 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.286 -0.884 . . . . 0.0 109.578 -179.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.497 ' C ' ' O ' ' A' ' 29' ' ' SER . . . -39.07 132.58 1.3 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.281 -0.887 . . . . 0.0 109.394 179.518 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 123.88 -41.03 1.82 Allowed Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.531 -1.428 . . . . 0.0 109.531 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 52.8 m-70 -57.29 102.1 0.08 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.205 -1.174 . . . . 0.0 109.447 179.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.416 ' HA ' ' HA ' ' A' ' 23' ' ' PRO . 99.6 mtt180 -53.67 132.39 40.76 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.229 -0.919 . . . . 0.0 109.458 179.555 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.607 ' OD1' ' N ' ' A' ' 35' ' ' VAL . 66.8 t0 -125.64 149.37 48.48 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.34 -0.85 . . . . 0.0 109.433 179.493 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.607 ' N ' ' OD1' ' A' ' 34' ' ' ASP . 64.0 t -117.06 133.75 62.82 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 O-C-N 121.247 -0.908 . . . . 0.0 109.469 -179.113 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.406 ' CZ ' ' OD2' ' A' ' 34' ' ' ASP . 96.7 m-85 -122.56 146.05 47.77 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.287 -0.883 . . . . 0.0 109.468 179.19 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.462 ' HB2' ' CE2' ' A' ' 45' ' ' PHE . 41.5 m-85 -116.07 151.34 35.74 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.262 -0.899 . . . . 0.0 109.501 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 67.5 m-85 -126.07 136.77 53.32 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.324 -0.86 . . . . 0.0 109.508 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.477 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.4 OUTLIER -98.05 178.98 1.17 Allowed Pre-proline 0 N--CA 1.49 1.547 0 O-C-N 121.285 -0.884 . . . . 0.0 109.433 179.695 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.477 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 43.0 Cg_exo -55.67 -30.21 74.35 Favored 'Trans proline' 0 C--N 1.304 -1.802 0 C-N-CA 122.779 2.32 . . . . 0.0 112.212 -179.831 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 99.8 p -87.37 4.07 44.52 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.225 -0.922 . . . . 0.0 109.488 -179.567 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 77.61 17.09 79.43 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.557 -1.417 . . . . 0.0 109.557 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.25 125.52 29.58 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.276 -1.132 . . . . 0.0 109.493 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 24.8 pttm -92.29 135.52 33.95 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.3 -0.875 . . . . 0.0 109.475 179.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.588 ' N ' ' CD1' ' A' ' 45' ' ' PHE . 1.3 p90 -140.34 146.92 39.09 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.262 -0.899 . . . . 0.0 109.416 179.714 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 19.0 ttm180 -131.56 59.36 1.7 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.241 -0.912 . . . . 0.0 109.548 179.296 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -160.92 141.65 11.47 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.234 -0.916 . . . . 0.0 109.421 -179.725 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.735 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 16.9 tptm -69.92 -37.92 8.5 Favored Pre-proline 0 N--CA 1.49 1.574 0 O-C-N 121.291 -0.881 . . . . 0.0 109.474 -179.291 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.735 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 33.6 Cg_exo -61.21 -51.24 4.68 Favored 'Trans proline' 0 C--N 1.305 -1.728 0 C-N-CA 122.866 2.378 . . . . 0.0 112.224 179.554 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -64.77 -34.9 79.42 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.257 -0.902 . . . . 0.0 109.463 179.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.542 HD23 ' O ' ' A' ' 51' ' ' LEU . 5.6 tt -62.44 -48.36 80.0 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.242 -0.911 . . . . 0.0 109.405 -179.759 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -69.91 -42.62 73.11 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.267 -0.896 . . . . 0.0 109.438 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 61.5 ttp180 -59.05 -41.37 87.76 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.389 -0.819 . . . . 0.0 109.539 179.453 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 50.4 t80 -60.0 -54.49 45.4 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.218 -0.926 . . . . 0.0 109.454 -179.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.511 HD12 HD22 ' A' ' 61' ' ' LEU . 36.3 mt -63.62 -42.07 98.22 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.199 -0.938 . . . . 0.0 109.473 179.821 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 72.73 -139.76 27.97 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -84.86 -0.1 89.11 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 78.0 p -66.43 -32.84 74.47 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.216 -1.167 . . . . 0.0 109.429 -179.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 44.4 mmm -144.42 135.78 25.5 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.213 -0.929 . . . . 0.0 109.469 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.578 ' C ' HD12 ' A' ' 61' ' ' LEU . 39.7 p-10 -93.13 112.3 24.2 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.231 -0.918 . . . . 0.0 109.551 179.326 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.578 HD12 ' C ' ' A' ' 60' ' ' ASP . 9.7 mp -117.67 14.14 14.36 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.153 -0.967 . . . . 0.0 109.507 -179.246 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 83.3 p -49.38 -34.82 17.09 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.201 -0.937 . . . . 0.0 109.49 179.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 40.3 p -100.33 36.06 1.96 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.234 -0.916 . . . . 0.0 109.435 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 80.2 t80 -105.71 129.14 53.99 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.274 -0.891 . . . . 0.0 109.497 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 55.1 t0 -86.68 118.77 26.3 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.3 -0.875 . . . . 0.0 109.456 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 65.3 t80 -81.44 -37.57 27.84 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.245 -0.909 . . . . 0.0 109.463 -179.519 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.416 HH11 ' HD3' ' A' ' 67' ' ' ARG . 24.4 mmt180 -63.95 -43.32 96.19 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.201 -0.937 . . . . 0.0 109.483 -179.054 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 71.1 p -95.61 -19.74 19.52 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.294 -0.879 . . . . 0.0 109.483 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.402 ' HA3' ' NH1' ' A' ' 19' ' ' ARG . . . 67.57 53.14 26.0 Favored Glycine 0 N--CA 1.489 2.232 0 N-CA-C 109.549 -1.421 . . . . 0.0 109.549 178.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 19.8 ptmt -150.3 151.77 33.46 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.199 -1.177 . . . . 0.0 109.433 179.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.407 ' HB2' ' HB2' ' A' ' 12' ' ' ALA . 38.1 ttm -95.22 124.81 39.45 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.22 -0.925 . . . . 0.0 109.494 -179.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 60.5 tp . . . . . 0 N--CA 1.49 1.553 0 O-C-N 121.262 -0.899 . . . . 0.0 109.472 -179.603 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.528 4.833 0 N-CA-C 119.361 2.504 . . . . 0.0 119.361 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 58.5 m -65.9 -72.46 0.16 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.268 -1.136 . . . . 0.0 109.464 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 77.7 mtm -92.4 120.16 32.63 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.237 -0.914 . . . . 0.0 109.429 179.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -105.71 167.45 9.76 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.308 -0.87 . . . . 0.0 109.484 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 66.7 ttp85 60.13 105.53 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.219 -0.926 . . . . 0.0 109.475 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 40.1 mttt -103.54 107.7 18.65 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.176 -0.952 . . . . 0.0 109.442 -179.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 3.4 ptp180 -70.07 167.01 18.57 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.241 -0.912 . . . . 0.0 109.487 -179.466 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.849 ' HE1' ' H ' ' A' ' 21' ' ' GLU . 60.9 m95 -143.33 129.42 19.69 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.246 -0.909 . . . . 0.0 109.499 179.827 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -58.06 139.12 55.28 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.25 -0.907 . . . . 0.0 109.546 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -71.16 126.92 91.98 Favored Pre-proline 0 N--CA 1.491 1.589 0 O-C-N 121.237 -0.915 . . . . 0.0 109.456 -179.717 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -74.06 -59.72 0.05 OUTLIER 'Trans proline' 0 C--N 1.303 -1.818 0 C-N-CA 122.823 2.348 . . . . 0.0 112.198 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.489 ' CB ' ' SD ' ' A' ' 71' ' ' MET . . . -116.28 -28.95 6.37 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.325 -0.859 . . . . 0.0 109.476 179.322 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.462 ' C ' ' O ' ' A' ' 12' ' ' ALA . 5.3 mp -40.7 157.49 0.18 Allowed Pre-proline 0 N--CA 1.491 1.608 0 O-C-N 121.177 -0.952 . . . . 0.0 109.462 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.501 ' HG2' ' CD1' ' A' ' 17' ' ' TRP . 34.0 Cg_endo -66.29 151.69 82.8 Favored 'Trans proline' 0 C--N 1.305 -1.746 0 C-N-CA 122.836 2.358 . . . . 0.0 112.205 179.042 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -58.58 123.45 16.31 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.268 -0.895 . . . . 0.0 109.498 -178.518 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 125.69 -27.14 5.26 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.489 -1.444 . . . . 0.0 109.489 178.419 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . 0.51 ' CZ2' HD21 ' A' ' 55' ' ' LEU . 15.5 m95 -84.78 143.23 29.25 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.235 -1.156 . . . . 0.0 109.441 179.585 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 75.1 tt0 -136.13 151.85 50.2 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.261 -0.899 . . . . 0.0 109.544 -178.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.494 HH11 ' HD2' ' A' ' 19' ' ' ARG . 26.5 mtm105 -121.88 163.25 19.55 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.242 -0.911 . . . . 0.0 109.445 178.373 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -155.78 128.53 7.92 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.214 -0.929 . . . . 0.0 109.492 -179.513 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.849 ' H ' ' HE1' ' A' ' 8' ' ' TRP . 92.0 mt-10 -89.8 134.19 34.32 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.278 -0.889 . . . . 0.0 109.324 178.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.524 ' O ' ' OD1' ' A' ' 34' ' ' ASP . 25.5 t -137.25 100.43 9.49 Favored Pre-proline 0 N--CA 1.49 1.557 0 O-C-N 121.225 -0.922 . . . . 0.0 109.61 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_exo -54.6 131.35 45.18 Favored 'Trans proline' 0 C--N 1.304 -1.789 0 C-N-CA 122.822 2.348 . . . . 0.0 112.207 179.001 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.477 HH12 ' HB2' ' A' ' 29' ' ' SER . 84.4 mtp180 -74.49 159.39 32.32 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.206 -0.934 . . . . 0.0 109.53 179.602 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 65.5 ttt180 -167.27 19.18 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.277 -0.89 . . . . 0.0 109.54 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -149.37 -43.4 0.14 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.369 -0.832 . . . . 0.0 109.543 -179.688 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.405 ' HA3' HH21 ' A' ' 24' ' ' ARG . . . -50.93 155.93 2.99 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 -179.816 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 57.3 tp -62.32 -41.36 98.49 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.319 -1.106 . . . . 0.0 109.481 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.539 ' O ' ' O ' ' A' ' 30' ' ' ALA . 73.4 m -83.03 13.2 4.18 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.261 -0.9 . . . . 0.0 109.451 -179.732 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.539 ' O ' ' O ' ' A' ' 29' ' ' SER . . . -42.39 169.68 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.273 -0.892 . . . . 0.0 109.475 179.709 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 113.73 -26.52 10.0 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.519 -1.433 . . . . 0.0 109.519 -179.481 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 30.3 m170 -107.88 -179.96 4.05 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.261 -1.141 . . . . 0.0 109.474 179.83 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -113.24 133.15 55.23 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.274 -0.891 . . . . 0.0 109.556 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.524 ' OD1' ' O ' ' A' ' 22' ' ' VAL . 7.5 p30 -104.25 136.65 43.46 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.352 -0.843 . . . . 0.0 109.484 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.402 HG22 ' HG2' ' A' ' 21' ' ' GLU . 38.9 t -110.79 134.78 51.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.358 -0.839 . . . . 0.0 109.477 179.317 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -114.36 149.49 36.02 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.294 -0.878 . . . . 0.0 109.516 -179.616 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.563 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 17.1 m-85 -118.83 149.82 40.88 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.197 -0.939 . . . . 0.0 109.467 179.515 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.436 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 15.0 m-85 -129.86 140.3 51.02 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.184 -0.947 . . . . 0.0 109.616 -179.696 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.43 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -109.74 176.94 1.36 Allowed Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.266 -0.896 . . . . 0.0 109.403 179.665 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.43 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 52.2 Cg_exo -53.26 -33.27 64.53 Favored 'Trans proline' 0 C--N 1.305 -1.741 0 C-N-CA 122.872 2.382 . . . . 0.0 112.246 179.551 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 20.9 t -76.41 -5.28 46.65 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.255 -0.903 . . . . 0.0 109.475 179.603 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 80.28 15.04 79.4 Favored Glycine 0 N--CA 1.489 2.206 0 N-CA-C 109.496 -1.442 . . . . 0.0 109.496 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -78.24 124.86 28.56 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.273 -1.134 . . . . 0.0 109.461 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.8 ptmm? -95.16 121.6 36.97 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.256 -0.903 . . . . 0.0 109.586 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -142.71 155.04 44.83 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.268 -0.895 . . . . 0.0 109.477 178.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.72 ' O ' ' C ' ' A' ' 47' ' ' SER . 5.0 ptt180 -130.77 -66.71 0.75 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.271 -0.893 . . . . 0.0 109.491 179.16 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.72 ' C ' ' O ' ' A' ' 46' ' ' ARG . 1.7 m -15.82 125.91 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.337 -0.852 . . . . 0.0 109.559 179.226 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.621 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 5.1 tmtp? -59.58 -45.56 98.7 Favored Pre-proline 0 N--CA 1.491 1.617 0 O-C-N 121.296 -0.877 . . . . 0.0 109.408 -179.646 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.621 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 52.5 Cg_exo -53.85 -46.08 36.28 Favored 'Trans proline' 0 C--N 1.305 -1.755 0 C-N-CA 122.837 2.358 . . . . 0.0 112.208 -179.42 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -66.41 -35.74 81.08 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.281 -0.887 . . . . 0.0 109.536 179.347 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 62.3 tp -63.04 -45.32 92.85 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.279 -0.888 . . . . 0.0 109.477 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.627 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -67.27 -40.58 86.18 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.174 -0.954 . . . . 0.0 109.472 -179.5 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 82.6 mtp180 -60.88 -42.14 97.37 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.331 -0.855 . . . . 0.0 109.517 -179.424 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 24.5 t80 -60.99 -53.83 52.45 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.189 -0.944 . . . . 0.0 109.464 -179.713 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.521 ' O ' ' N ' ' A' ' 57' ' ' GLY . 93.2 mt -88.13 1.89 53.3 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.29 -0.881 . . . . 0.0 109.504 179.356 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.627 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -44.67 94.69 0.01 OUTLIER Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.46 -1.456 . . . . 0.0 109.46 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . 0.521 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . 125.05 -52.33 0.8 Allowed Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.465 -1.454 . . . . 0.0 109.465 179.837 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.1 m -63.0 -34.6 77.89 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.213 -1.169 . . . . 0.0 109.454 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 51.6 ttp -163.98 157.81 18.92 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.251 -0.906 . . . . 0.0 109.465 -179.576 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.403 ' C ' HD22 ' A' ' 61' ' ' LEU . 51.4 t0 -89.38 110.26 21.09 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.252 -0.905 . . . . 0.0 109.512 -179.688 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.534 ' N ' HD22 ' A' ' 61' ' ' LEU . 4.0 mm? -93.78 -3.76 51.51 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.267 -0.896 . . . . 0.0 109.469 -179.733 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 38.4 t -59.45 -39.49 83.77 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.216 -0.927 . . . . 0.0 109.395 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 65.9 p -86.71 14.55 6.87 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.182 -0.949 . . . . 0.0 109.424 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -91.55 129.64 37.5 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.177 -0.952 . . . . 0.0 109.462 -179.836 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.52 ' O ' ' N ' ' A' ' 69' ' ' GLY . 60.9 t0 -80.03 112.19 17.1 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.196 -0.94 . . . . 0.0 109.472 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.563 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 48.2 t80 -75.13 -44.15 48.59 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.233 -0.917 . . . . 0.0 109.468 -179.006 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.418 ' HD2' ' N ' ' A' ' 67' ' ' ARG . 10.9 mpt_? -60.34 -42.52 95.88 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.198 -0.939 . . . . 0.0 109.518 -178.794 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.482 ' OG1' ' CG ' ' A' ' 65' ' ' ASP . 30.0 p -97.83 -13.85 21.08 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.302 -0.874 . . . . 0.0 109.497 -179.459 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.52 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 63.25 39.47 97.92 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.481 -1.448 . . . . 0.0 109.481 -179.841 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.438 ' H ' ' HB3' ' A' ' 65' ' ' ASP . 51.4 mttp -137.35 156.55 48.09 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.223 -1.163 . . . . 0.0 109.461 -179.487 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.489 ' SD ' ' CB ' ' A' ' 12' ' ' ALA . 37.2 mtt -84.95 148.47 26.2 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.199 -0.938 . . . . 0.0 109.442 -180.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 56.0 tp . . . . . 0 N--CA 1.49 1.546 0 O-C-N 121.282 -0.886 . . . . 0.0 109.446 179.967 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.499 ' O ' ' O ' ' A' ' 2' ' ' SER . . . . . . . . 1 N--CA 1.529 4.834 0 N-CA-C 119.378 2.511 . . . . 0.0 119.378 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.499 ' O ' ' O ' ' A' ' 1' ' ' GLY . 1.4 t 51.33 103.31 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.255 -1.144 . . . . 0.0 109.537 -179.602 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -79.42 116.55 19.72 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.331 -0.856 . . . . 0.0 109.416 -179.873 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -142.99 -157.52 0.78 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.304 -0.872 . . . . 0.0 109.472 179.593 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 35.3 ptt180 -76.95 142.39 40.05 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.331 -0.855 . . . . 0.0 109.47 179.815 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.437 ' HD3' ' N ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -114.39 113.09 24.05 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.244 -0.91 . . . . 0.0 109.442 179.883 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.52 ' NH2' ' OE1' ' A' ' 18' ' ' GLU . 69.4 mtp85 -72.01 168.06 18.84 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.273 -0.892 . . . . 0.0 109.38 -179.932 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.59 ' N ' ' O ' ' A' ' 19' ' ' ARG . 53.0 m95 -136.28 124.7 23.42 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.197 -0.939 . . . . 0.0 109.427 -179.418 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.521 ' N ' ' OE1' ' A' ' 9' ' ' GLU . 58.5 mp0 -90.78 117.07 29.12 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.279 -0.888 . . . . 0.0 109.398 179.769 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.419 ' SG ' ' HB3' ' A' ' 12' ' ' ALA . 46.4 t -119.24 100.32 50.15 Favored Pre-proline 0 N--CA 1.491 1.608 0 O-C-N 121.34 -0.85 . . . . 0.0 109.522 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_exo -55.2 -25.44 46.38 Favored 'Trans proline' 0 C--N 1.305 -1.749 0 C-N-CA 122.945 2.43 . . . . 0.0 112.19 178.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.455 ' HB1' ' SD ' ' A' ' 71' ' ' MET . . . -57.45 -35.08 69.65 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.267 -0.895 . . . . 0.0 109.47 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.671 HD22 ' N ' ' A' ' 13' ' ' LEU . 3.2 mm? -89.97 154.9 47.64 Favored Pre-proline 0 N--CA 1.49 1.555 0 O-C-N 121.201 -0.937 . . . . 0.0 109.402 179.793 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_exo -52.1 146.7 29.4 Favored 'Trans proline' 0 C--N 1.306 -1.709 0 C-N-CA 122.78 2.32 . . . . 0.0 112.231 179.064 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 8.7 mp0 -55.29 124.08 15.89 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.252 -0.905 . . . . 0.0 109.509 -179.757 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 124.31 -22.47 6.64 Favored Glycine 0 N--CA 1.49 2.243 0 N-CA-C 109.647 -1.381 . . . . 0.0 109.647 179.427 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 52.4 m95 -85.36 136.16 33.59 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.177 -1.19 . . . . 0.0 109.473 179.205 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.52 ' OE1' ' NH2' ' A' ' 7' ' ' ARG . 72.4 mt-10 -142.41 155.7 45.14 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.326 -0.859 . . . . 0.0 109.424 -179.126 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.615 HH22 ' CD2' ' A' ' 13' ' ' LEU . 0.0 OUTLIER -138.56 140.24 38.97 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.211 -0.93 . . . . 0.0 109.399 178.953 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -132.89 142.59 49.0 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.241 -0.912 . . . . 0.0 109.481 -178.365 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.521 ' HG3' ' HE1' ' A' ' 8' ' ' TRP . 92.4 mt-10 -98.99 142.58 30.3 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.376 -0.827 . . . . 0.0 109.392 178.391 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 10.4 t -145.17 123.39 6.53 Favored Pre-proline 0 N--CA 1.491 1.598 0 O-C-N 121.219 -0.925 . . . . 0.0 109.611 -179.535 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -74.84 135.55 19.56 Favored 'Trans proline' 0 C--N 1.304 -1.813 0 C-N-CA 122.879 2.386 . . . . 0.0 112.214 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.438 HH21 ' HA3' ' A' ' 27' ' ' GLY . 78.3 mtp85 -78.24 166.21 22.99 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.273 -0.892 . . . . 0.0 109.484 179.652 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 57.5 ttp180 -170.33 -9.2 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.213 -0.93 . . . . 0.0 109.523 -179.425 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 15.9 t -126.84 -20.8 4.17 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.251 -0.906 . . . . 0.0 109.417 -179.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.438 ' HA3' HH21 ' A' ' 24' ' ' ARG . . . -73.36 165.83 54.73 Favored Glycine 0 N--CA 1.492 2.387 0 N-CA-C 109.549 -1.42 . . . . 0.0 109.549 -179.831 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.408 ' HA ' HD12 ' A' ' 28' ' ' LEU . 58.3 tp -62.54 -40.94 98.38 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.255 -1.144 . . . . 0.0 109.461 179.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.541 ' O ' ' C ' ' A' ' 30' ' ' ALA . 83.7 p -79.8 15.34 1.42 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.292 -0.88 . . . . 0.0 109.442 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.541 ' C ' ' O ' ' A' ' 29' ' ' SER . . . -35.89 152.82 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.21 -0.931 . . . . 0.0 109.475 179.804 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 102.9 -37.68 3.59 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.554 -1.418 . . . . 0.0 109.554 -179.625 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 33.2 m170 -85.39 168.44 14.62 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.356 -1.084 . . . . 0.0 109.455 179.555 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -114.98 128.04 56.04 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.245 -0.909 . . . . 0.0 109.518 -179.52 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 22.7 m-20 -106.92 137.42 45.01 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.211 -0.931 . . . . 0.0 109.419 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.426 HG22 ' HG2' ' A' ' 21' ' ' GLU . 3.0 t -106.91 135.03 46.83 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.246 -0.909 . . . . 0.0 109.411 179.577 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -113.7 141.54 47.11 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.313 -0.867 . . . . 0.0 109.524 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.709 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 17.5 m-85 -114.36 142.05 46.83 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.281 -0.887 . . . . 0.0 109.357 -179.352 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 86.2 m-85 -123.06 135.09 54.27 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.307 -0.871 . . . . 0.0 109.47 -179.607 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.454 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -97.2 177.56 1.63 Allowed Pre-proline 0 N--CA 1.491 1.592 0 O-C-N 121.191 -0.943 . . . . 0.0 109.426 179.593 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.454 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 47.4 Cg_exo -54.49 -31.37 68.78 Favored 'Trans proline' 0 C--N 1.304 -1.809 0 C-N-CA 122.848 2.365 . . . . 0.0 112.258 -179.656 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 71.8 m -88.62 7.08 35.21 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.316 -0.865 . . . . 0.0 109.476 179.561 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 79.95 10.7 85.33 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 -179.584 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -64.22 122.75 17.37 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.168 -1.195 . . . . 0.0 109.457 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 13.5 ptpt -95.88 126.88 41.44 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.242 -0.911 . . . . 0.0 109.525 178.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.634 ' N ' ' CD1' ' A' ' 45' ' ' PHE . 1.1 p90 -139.92 146.46 39.24 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.296 -0.877 . . . . 0.0 109.47 -179.919 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 28.4 ptt-85 -134.79 53.59 1.98 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.3 -0.875 . . . . 0.0 109.549 179.213 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.4 p -159.41 144.71 15.77 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.285 -0.884 . . . . 0.0 109.563 -179.824 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.666 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 0.6 OUTLIER -69.39 -42.29 20.06 Favored Pre-proline 0 N--CA 1.49 1.545 0 O-C-N 121.211 -0.931 . . . . 0.0 109.4 -179.473 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.666 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 42.9 Cg_exo -57.54 -48.98 14.83 Favored 'Trans proline' 0 C--N 1.305 -1.752 0 C-N-CA 122.898 2.399 . . . . 0.0 112.231 -179.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.434 HE21 ' HB2' ' A' ' 45' ' ' PHE . 18.3 tt0 -65.84 -38.07 87.89 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.275 -0.891 . . . . 0.0 109.388 179.54 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.516 HD13 ' CE2' ' A' ' 45' ' ' PHE . 37.0 tp -64.02 -45.41 89.02 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.274 -0.891 . . . . 0.0 109.493 -179.636 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.591 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -65.86 -43.98 86.77 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.262 -0.899 . . . . 0.0 109.425 -179.665 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 15.1 tpp180 -56.06 -42.88 77.33 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.251 -0.905 . . . . 0.0 109.448 -179.419 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 56.2 t80 -61.1 -52.14 66.17 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.207 -0.933 . . . . 0.0 109.387 -179.215 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.496 HD12 ' O ' ' A' ' 56' ' ' GLY . 2.5 pp -86.9 0.94 54.14 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.228 -0.92 . . . . 0.0 109.492 179.718 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.591 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . 44.17 -121.8 4.06 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 -179.743 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -110.01 31.71 7.27 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.595 -1.402 . . . . 0.0 109.595 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 38.2 t -87.82 -21.11 25.25 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.228 -1.16 . . . . 0.0 109.458 -179.579 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 63.8 mmm -139.07 130.39 26.93 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.173 -0.954 . . . . 0.0 109.454 -179.64 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 63.0 t0 -90.79 106.38 18.47 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.272 -0.893 . . . . 0.0 109.479 179.191 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.416 ' O ' ' C ' ' A' ' 62' ' ' SER . 98.6 mt -93.47 4.44 53.95 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.23 -0.919 . . . . 0.0 109.487 -179.308 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.416 ' C ' ' O ' ' A' ' 61' ' ' LEU . 39.7 t -42.9 -39.71 2.66 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.285 -0.884 . . . . 0.0 109.484 179.577 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 67.9 p -98.57 48.39 0.98 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.238 -0.914 . . . . 0.0 109.417 179.345 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -124.25 131.0 53.5 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.299 -0.875 . . . . 0.0 109.482 -179.499 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.459 ' CG ' ' OG1' ' A' ' 68' ' ' THR . 55.7 t0 -89.94 104.59 17.14 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.125 -0.984 . . . . 0.0 109.463 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.709 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 68.2 t80 -74.16 -49.34 24.04 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.195 -0.94 . . . . 0.0 109.501 -179.231 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 19.0 mmm180 -51.43 -37.6 49.45 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.171 -0.956 . . . . 0.0 109.449 -179.624 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.459 ' OG1' ' CG ' ' A' ' 65' ' ' ASP . 22.3 p -100.45 -11.21 20.38 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.265 -0.897 . . . . 0.0 109.481 -179.881 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 62.12 34.23 88.37 Favored Glycine 0 N--CA 1.491 2.361 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 179.768 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 62.0 mttp -127.86 147.38 50.45 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.215 -1.167 . . . . 0.0 109.475 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.455 ' SD ' ' HB1' ' A' ' 12' ' ' ALA . 3.6 tpt -77.87 140.26 39.32 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.184 -0.947 . . . . 0.0 109.513 179.774 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 60.4 tp . . . . . 0 N--CA 1.49 1.548 0 O-C-N 121.222 -0.924 . . . . 0.0 109.458 179.87 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.529 4.869 0 N-CA-C 119.449 2.54 . . . . 0.0 119.449 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.458 ' O ' ' C ' ' A' ' 3' ' ' MET . 22.3 t -65.53 146.5 54.78 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.277 -1.131 . . . . 0.0 109.474 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.458 ' C ' ' O ' ' A' ' 2' ' ' SER . 5.3 ttt 41.04 -157.83 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.217 -0.927 . . . . 0.0 109.454 -179.783 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.402 ' H ' ' HG2' ' A' ' 3' ' ' MET . 96.9 mt-10 -145.17 93.3 2.37 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.274 -0.891 . . . . 0.0 109.523 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 88.1 mtm180 -87.13 141.02 28.96 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.232 -0.917 . . . . 0.0 109.446 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.532 ' HB2' ' H ' ' A' ' 21' ' ' GLU . 11.3 mptt -76.06 139.97 41.67 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.365 -0.835 . . . . 0.0 109.521 179.742 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -157.44 92.3 1.22 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.265 -0.897 . . . . 0.0 109.508 -179.558 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.657 ' HE1' ' HE ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -122.27 149.22 44.01 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.19 -0.944 . . . . 0.0 109.509 179.304 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -62.7 150.83 40.04 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.276 -0.89 . . . . 0.0 109.505 179.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.448 ' SG ' ' C ' ' A' ' 18' ' ' GLU . 10.9 m -93.45 114.3 62.51 Favored Pre-proline 0 N--CA 1.492 1.644 0 O-C-N 121.251 -0.906 . . . . 0.0 109.517 -179.644 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -76.87 -39.4 0.65 Allowed 'Trans proline' 0 C--N 1.306 -1.689 0 C-N-CA 122.821 2.347 . . . . 0.0 112.233 179.389 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.406 ' C ' HD22 ' A' ' 13' ' ' LEU . . . -66.17 -36.39 82.98 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.211 -0.931 . . . . 0.0 109.554 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.702 HD22 ' N ' ' A' ' 13' ' ' LEU . 3.4 mm? -88.23 156.91 51.26 Favored Pre-proline 0 N--CA 1.49 1.555 0 O-C-N 121.17 -0.956 . . . . 0.0 109.452 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -52.2 142.79 44.61 Favored 'Trans proline' 0 C--N 1.306 -1.692 0 C-N-CA 122.802 2.334 . . . . 0.0 112.154 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 98.5 mm-40 -47.09 131.96 12.36 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.189 -0.944 . . . . 0.0 109.465 -179.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 120.61 -21.65 8.47 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 179.847 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . 0.413 ' CH2' HD11 ' A' ' 55' ' ' LEU . 18.1 m95 -84.47 147.89 26.84 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.133 -1.216 . . . . 0.0 109.473 179.688 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.448 ' C ' ' SG ' ' A' ' 10' ' ' CYS . 94.1 mt-10 -127.51 148.14 50.32 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.274 -0.891 . . . . 0.0 109.42 -178.679 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.657 ' HE ' ' HE1' ' A' ' 8' ' ' TRP . 52.0 ttp180 -130.83 126.22 35.69 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.249 -0.907 . . . . 0.0 109.474 179.51 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -129.63 139.03 51.53 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.227 -0.921 . . . . 0.0 109.499 -179.537 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.532 ' H ' ' HB2' ' A' ' 6' ' ' LYS . 77.9 tt0 -101.51 145.63 28.74 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.325 -0.859 . . . . 0.0 109.362 179.06 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.5 t -142.56 121.82 7.74 Favored Pre-proline 0 N--CA 1.49 1.572 0 O-C-N 121.115 -0.991 . . . . 0.0 109.54 -179.159 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -78.73 144.57 19.59 Favored 'Trans proline' 0 C--N 1.305 -1.755 0 C-N-CA 122.797 2.331 . . . . 0.0 112.161 178.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.81 ' NE ' ' H ' ' A' ' 24' ' ' ARG . 0.0 OUTLIER -91.52 176.01 6.7 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.181 -0.949 . . . . 0.0 109.489 179.563 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 95.9 mtt-85 -127.06 24.88 6.31 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.207 -0.933 . . . . 0.0 109.502 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.531 ' OG ' ' CB ' ' A' ' 29' ' ' SER . 97.0 p -64.86 161.61 17.96 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.286 -0.884 . . . . 0.0 109.468 -179.732 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -62.25 -96.78 0.01 OUTLIER Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.515 -1.434 . . . . 0.0 109.515 -179.568 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.53 ' C ' ' H ' ' A' ' 30' ' ' ALA . 96.7 mt -65.21 -34.73 79.06 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.299 -1.118 . . . . 0.0 109.553 -178.592 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.571 ' O ' ' OG ' ' A' ' 29' ' ' SER . 0.3 OUTLIER -70.96 21.92 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.241 -0.912 . . . . 0.0 109.443 -179.007 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.53 ' H ' ' C ' ' A' ' 28' ' ' LEU . . . -79.57 164.35 23.92 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.195 -0.94 . . . . 0.0 109.491 179.884 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.715 ' H ' ' NH1' ' A' ' 24' ' ' ARG . . . 86.7 -17.37 40.59 Favored Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.487 -1.445 . . . . 0.0 109.487 179.565 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.595 ' O ' ' NE ' ' A' ' 24' ' ' ARG . 75.7 m80 -79.25 126.35 30.67 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.259 -1.142 . . . . 0.0 109.395 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 7.4 mtp180 -112.08 118.82 36.46 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.218 -0.927 . . . . 0.0 109.492 179.554 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -91.96 139.49 30.6 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.235 -0.916 . . . . 0.0 109.394 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.6 t -106.7 123.03 61.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.271 -0.893 . . . . 0.0 109.405 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -107.36 140.61 40.02 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.208 -0.933 . . . . 0.0 109.47 179.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.544 ' CD1' ' CE1' ' A' ' 66' ' ' PHE . 71.9 m-85 -109.4 142.25 40.62 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.251 -0.906 . . . . 0.0 109.471 -179.216 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 80.2 m-85 -126.39 139.29 53.39 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.242 -0.911 . . . . 0.0 109.496 -179.742 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.405 ' CB ' ' HD2' ' A' ' 40' ' ' PRO . 0.4 OUTLIER -99.7 165.22 15.07 Favored Pre-proline 0 N--CA 1.49 1.568 0 O-C-N 121.362 -0.836 . . . . 0.0 109.443 179.53 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.405 ' HD2' ' CB ' ' A' ' 39' ' ' SER . 20.5 Cg_endo -60.47 -19.1 57.59 Favored 'Trans proline' 0 C--N 1.305 -1.747 0 C-N-CA 122.805 2.337 . . . . 0.0 112.201 179.833 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 56.7 p -88.52 0.04 56.73 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.361 -0.837 . . . . 0.0 109.511 179.411 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 85.6 13.11 70.91 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -78.21 117.66 19.7 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.204 -1.174 . . . . 0.0 109.479 -179.773 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.75 ' HZ3' HH11 ' A' ' 46' ' ' ARG . 62.8 tttm -92.81 128.37 38.64 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.295 -0.878 . . . . 0.0 109.402 178.689 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.635 ' N ' ' CD1' ' A' ' 45' ' ' PHE . 1.1 p90 -140.24 146.8 39.12 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.202 -0.936 . . . . 0.0 109.479 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.75 HH11 ' HZ3' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -141.7 59.78 1.49 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.218 -0.926 . . . . 0.0 109.525 179.008 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.1 t -157.73 144.97 18.29 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.231 -0.918 . . . . 0.0 109.568 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.603 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 3.8 tttt -68.5 -46.06 36.23 Favored Pre-proline 0 N--CA 1.49 1.575 0 O-C-N 121.176 -0.953 . . . . 0.0 109.437 -179.355 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.603 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 45.6 Cg_exo -55.77 -46.72 29.59 Favored 'Trans proline' 0 C--N 1.306 -1.695 0 C-N-CA 122.77 2.314 . . . . 0.0 112.23 -179.689 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -67.16 -39.94 86.57 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.208 -0.933 . . . . 0.0 109.447 179.794 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 57.0 tp -64.87 -45.81 84.44 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.252 -0.905 . . . . 0.0 109.497 -179.476 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.691 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -69.98 -45.3 67.63 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.271 -0.893 . . . . 0.0 109.474 -179.288 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 77.5 ttt-85 -60.18 -43.52 95.78 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.2 -0.938 . . . . 0.0 109.545 -179.697 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 37.5 t80 -62.43 -55.61 26.06 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.293 -0.879 . . . . 0.0 109.518 -179.114 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.488 ' CD1' HD12 ' A' ' 13' ' ' LEU . 96.4 mt -90.34 4.92 49.4 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.202 -0.936 . . . . 0.0 109.532 179.885 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.691 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -48.6 -77.37 0.12 Allowed Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 -179.643 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.09 7.47 0.2 Allowed Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 -179.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.577 ' H ' ' C ' ' A' ' 56' ' ' GLY . 3.6 p -108.77 -26.85 10.09 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.209 -1.171 . . . . 0.0 109.498 -179.61 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.629 ' SD ' HD21 ' A' ' 61' ' ' LEU . 18.1 ptm -176.2 170.13 2.68 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.192 -0.942 . . . . 0.0 109.431 -179.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.518 ' O ' ' OD1' ' A' ' 60' ' ' ASP . 45.3 p-10 -97.24 116.47 29.51 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.317 -0.865 . . . . 0.0 109.452 179.655 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.629 HD21 ' SD ' ' A' ' 59' ' ' MET . 88.5 mt -111.8 16.45 20.45 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.352 -0.843 . . . . 0.0 109.463 -179.414 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 41.0 t -58.77 -39.28 80.57 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.284 -0.885 . . . . 0.0 109.436 -179.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 51.7 p -92.03 23.98 3.48 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.357 -0.84 . . . . 0.0 109.413 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 46.5 t80 -99.72 125.71 45.65 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.248 -0.907 . . . . 0.0 109.476 -179.729 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.437 ' OD2' ' OG1' ' A' ' 68' ' ' THR . 55.3 t0 -83.63 119.31 24.6 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.261 -0.899 . . . . 0.0 109.418 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.544 ' CE1' ' CD1' ' A' ' 37' ' ' TYR . 73.8 t80 -83.02 -33.23 26.55 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.235 -0.916 . . . . 0.0 109.541 -179.541 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 42.3 ttm180 -66.18 -43.94 85.43 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.264 -0.897 . . . . 0.0 109.529 -179.214 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.631 ' O ' ' NH1' ' A' ' 19' ' ' ARG . 11.3 p -96.47 -15.91 21.45 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.278 -0.889 . . . . 0.0 109.503 -179.867 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.52 ' HA3' HH11 ' A' ' 19' ' ' ARG . . . 64.52 60.45 7.02 Favored Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.497 -1.441 . . . . 0.0 109.497 179.375 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -152.96 149.74 28.52 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.318 -1.107 . . . . 0.0 109.423 179.599 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 34.6 ttm -91.63 121.41 33.27 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.208 -0.932 . . . . 0.0 109.522 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.54 ' C ' HD23 ' A' ' 72' ' ' LEU . 3.4 tt . . . . . 0 N--CA 1.491 1.598 0 O-C-N 121.278 -0.889 . . . . 0.0 109.458 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.527 4.736 0 N-CA-C 119.538 2.575 . . . . 0.0 119.538 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 54.6 p -148.15 -157.69 0.84 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.219 -1.165 . . . . 0.0 109.462 179.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 72.5 mtm -72.87 101.87 3.27 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.334 -0.854 . . . . 0.0 109.445 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.604 ' O ' ' C ' ' A' ' 5' ' ' ARG . 96.4 mt-10 -96.61 165.3 12.21 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.257 -0.902 . . . . 0.0 109.502 179.712 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.604 ' C ' ' O ' ' A' ' 4' ' ' GLU . 5.7 ptp180 31.51 95.12 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.19 -0.944 . . . . 0.0 109.451 179.332 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.585 ' NZ ' ' O ' ' A' ' 21' ' ' GLU . 0.3 OUTLIER -120.68 123.35 42.53 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.294 -0.879 . . . . 0.0 109.526 179.948 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 83.7 mtp180 -100.66 108.44 20.32 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.246 -0.909 . . . . 0.0 109.501 -179.306 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 15.2 m0 -104.37 169.71 8.32 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.212 -0.93 . . . . 0.0 109.472 178.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -88.83 146.04 25.21 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.212 -0.93 . . . . 0.0 109.408 -179.661 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 17.8 t -121.34 100.73 44.67 Favored Pre-proline 0 N--CA 1.489 1.484 0 O-C-N 121.247 -0.908 . . . . 0.0 109.499 179.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -53.11 -40.18 77.7 Favored 'Trans proline' 0 C--N 1.304 -1.776 0 C-N-CA 122.864 2.376 . . . . 0.0 112.23 -179.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.42 -28.95 60.9 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.262 -0.899 . . . . 0.0 109.52 -179.725 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 14.5 mt -91.67 151.38 42.31 Favored Pre-proline 0 N--CA 1.49 1.53 0 O-C-N 121.302 -0.874 . . . . 0.0 109.436 -179.757 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -51.1 154.6 7.34 Favored 'Trans proline' 0 C--N 1.306 -1.709 0 C-N-CA 122.746 2.297 . . . . 0.0 112.256 179.029 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 89.5 mt-30 -58.25 121.02 9.73 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.254 -0.904 . . . . 0.0 109.477 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 124.52 -36.19 2.97 Favored Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 -179.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . 0.432 ' CZ2' HD11 ' A' ' 55' ' ' LEU . 37.5 m95 -74.61 149.02 40.22 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.219 -1.165 . . . . 0.0 109.453 178.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -139.46 153.35 47.53 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.139 -0.976 . . . . 0.0 109.489 -178.437 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.552 ' NH1' ' O ' ' A' ' 68' ' ' THR . 60.8 ttp180 -106.56 156.44 18.58 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.179 -0.951 . . . . 0.0 109.423 178.544 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.408 ' N ' ' HG2' ' A' ' 19' ' ' ARG . 39.2 tt0 -142.53 140.53 31.84 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.226 -0.921 . . . . 0.0 109.557 -178.572 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.585 ' O ' ' NZ ' ' A' ' 6' ' ' LYS . 81.2 mm-40 -113.92 121.04 42.74 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.187 -0.945 . . . . 0.0 109.407 178.004 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 39.2 t -128.79 133.78 25.58 Favored Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.215 -0.928 . . . . 0.0 109.609 -178.671 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -76.47 171.45 18.04 Favored 'Trans proline' 0 C--N 1.306 -1.703 0 C-N-CA 122.825 2.35 . . . . 0.0 112.221 178.21 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.548 ' NE ' ' OD2' ' A' ' 34' ' ' ASP . 12.7 mmt85 -105.55 126.86 52.62 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.333 -0.854 . . . . 0.0 109.366 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.752 ' O ' ' C ' ' A' ' 26' ' ' SER . 85.0 mtp180 -106.3 -34.71 7.38 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.112 -0.992 . . . . 0.0 109.512 -179.568 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.752 ' C ' ' O ' ' A' ' 25' ' ' ARG . 81.1 p 4.27 -112.17 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.241 -0.912 . . . . 0.0 109.477 -179.431 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -150.99 -94.69 0.11 Allowed Glycine 0 N--CA 1.49 2.235 0 N-CA-C 109.621 -1.392 . . . . 0.0 109.621 179.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 56.2 tp -68.28 -46.55 70.06 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.226 -1.161 . . . . 0.0 109.414 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 37.7 t -70.61 -10.19 58.73 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.322 -0.862 . . . . 0.0 109.429 -179.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.508 ' HB2' ' O ' ' A' ' 25' ' ' ARG . . . -51.01 147.89 4.75 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.26 -0.9 . . . . 0.0 109.459 179.589 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 124.37 -34.23 3.57 Favored Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 36.2 m80 -73.89 169.48 17.32 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.247 -1.149 . . . . 0.0 109.454 178.649 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 19.1 ptp180 -128.94 150.75 50.25 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.212 -0.93 . . . . 0.0 109.493 -179.491 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.548 ' OD2' ' NE ' ' A' ' 24' ' ' ARG . 69.5 m-20 -129.68 146.24 51.47 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.264 -0.897 . . . . 0.0 109.454 179.497 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.473 HG22 ' OE1' ' A' ' 21' ' ' GLU . 33.3 t -105.06 132.4 51.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.225 -0.922 . . . . 0.0 109.446 -179.258 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 81.3 m-85 -122.75 152.45 40.61 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.161 -0.962 . . . . 0.0 109.505 179.137 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 68.0 m-85 -123.87 149.29 45.97 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.193 -0.942 . . . . 0.0 109.49 -179.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 53.5 m-85 -116.08 128.19 55.48 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.263 -0.898 . . . . 0.0 109.643 -179.397 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.535 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.5 OUTLIER -92.61 -177.94 0.8 Allowed Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.299 -0.876 . . . . 0.0 109.444 179.195 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.535 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 51.2 Cg_exo -55.37 -31.44 77.36 Favored 'Trans proline' 0 C--N 1.305 -1.746 0 C-N-CA 122.885 2.39 . . . . 0.0 112.248 -179.544 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.452 ' O ' ' OG ' ' A' ' 41' ' ' SER . 0.1 OUTLIER -93.05 11.81 26.28 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.184 -0.947 . . . . 0.0 109.528 179.019 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 73.66 14.85 79.54 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 -179.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 5.6 ttmt -64.36 128.73 37.05 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.175 -1.191 . . . . 0.0 109.44 -179.504 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 9.8 mtpm? -94.45 118.09 31.12 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.282 -0.886 . . . . 0.0 109.455 178.685 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 55.0 p90 -139.4 146.21 39.89 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.284 -0.885 . . . . 0.0 109.44 -179.638 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 26.6 ptt180 -126.32 57.78 1.39 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.336 -0.852 . . . . 0.0 109.493 179.345 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.5 t -150.45 130.33 13.33 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.236 -0.915 . . . . 0.0 109.504 179.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.852 ' N ' ' HD2' ' A' ' 49' ' ' PRO . 7.6 tmtt? -63.48 -46.81 84.17 Favored Pre-proline 0 N--CA 1.49 1.533 0 O-C-N 121.222 -0.924 . . . . 0.0 109.503 -179.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.852 ' HD2' ' N ' ' A' ' 48' ' ' LYS . 18.3 Cg_endo -57.95 -37.08 97.43 Favored 'Trans proline' 0 C--N 1.305 -1.734 0 C-N-CA 122.812 2.341 . . . . 0.0 112.235 178.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 59.2 tt0 -67.66 -38.28 83.57 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.207 -0.933 . . . . 0.0 109.478 179.277 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.698 HD23 ' O ' ' A' ' 51' ' ' LEU . 2.0 tt -63.64 -42.32 98.14 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.26 -0.9 . . . . 0.0 109.505 -179.817 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.89 -39.75 90.94 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.28 -0.888 . . . . 0.0 109.491 -179.551 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 13.6 tpp180 -55.9 -45.98 78.48 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.254 -0.904 . . . . 0.0 109.521 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -62.59 -47.87 81.9 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.24 -0.913 . . . . 0.0 109.484 179.537 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.432 HD11 ' CZ2' ' A' ' 17' ' ' TRP . 8.1 mp -65.26 -0.59 1.84 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.291 -0.88 . . . . 0.0 109.437 179.504 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.551 ' O ' ' C ' ' A' ' 57' ' ' GLY . . . 56.37 60.36 9.09 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.616 -1.394 . . . . 0.0 109.616 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . 0.551 ' C ' ' O ' ' A' ' 56' ' ' GLY . . . 34.34 38.41 0.11 Allowed Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 -179.351 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.468 ' N ' ' O ' ' A' ' 56' ' ' GLY . 89.0 p -88.95 -0.89 57.79 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.294 -1.121 . . . . 0.0 109.436 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.499 ' CE ' HD21 ' A' ' 61' ' ' LEU . 33.1 ttp -155.46 148.74 24.82 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.224 -0.922 . . . . 0.0 109.548 -179.736 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 55.1 t0 -85.76 101.81 13.11 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.232 -0.917 . . . . 0.0 109.482 -179.585 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.499 HD21 ' CE ' ' A' ' 59' ' ' MET . 89.1 mt -96.41 1.18 51.47 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.258 -0.901 . . . . 0.0 109.449 179.56 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 58.6 m -54.93 -27.19 41.49 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.143 -0.973 . . . . 0.0 109.458 179.585 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 36.1 p -94.11 1.46 56.13 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.27 -0.894 . . . . 0.0 109.547 179.563 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.435 ' CZ ' ' HA2' ' A' ' 69' ' ' GLY . 72.9 t80 -87.87 114.52 24.56 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.247 -0.908 . . . . 0.0 109.512 179.459 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -76.23 136.81 39.69 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.268 -0.895 . . . . 0.0 109.465 -179.498 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 69.4 t80 -89.15 -37.34 15.13 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.144 -0.972 . . . . 0.0 109.44 179.446 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 29.0 tpt85 -59.35 -44.44 92.67 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.278 -0.889 . . . . 0.0 109.461 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.552 ' O ' ' NH1' ' A' ' 19' ' ' ARG . 33.1 p -97.54 -20.53 17.65 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.324 -0.86 . . . . 0.0 109.485 179.659 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.457 ' HA3' HH11 ' A' ' 19' ' ' ARG . . . 67.21 31.46 77.47 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.56 -1.416 . . . . 0.0 109.56 179.667 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.407 ' HZ2' HH12 ' A' ' 19' ' ' ARG . 64.6 mttp -132.11 152.58 51.15 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.232 -1.157 . . . . 0.0 109.525 -179.655 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 17.4 mtt -78.73 144.53 35.16 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.211 -0.931 . . . . 0.0 109.466 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.661 ' C ' HD23 ' A' ' 72' ' ' LEU . 5.1 tt . . . . . 0 N--CA 1.49 1.564 0 O-C-N 121.213 -0.929 . . . . 0.0 109.413 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.529 4.879 0 N-CA-C 119.384 2.513 . . . . 0.0 119.384 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 86.5 p -89.17 -1.48 58.11 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.214 -1.168 . . . . 0.0 109.536 179.877 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 81.4 mmm 46.18 -144.88 0.22 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.248 -0.907 . . . . 0.0 109.456 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.572 ' O ' ' O ' ' A' ' 5' ' ' ARG . 15.9 pt-20 -93.26 34.58 1.13 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.329 -0.857 . . . . 0.0 109.442 -179.187 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.584 ' NH2' ' OE2' ' A' ' 20' ' ' GLU . 50.0 mtp180 57.45 139.55 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.182 -0.949 . . . . 0.0 109.479 179.625 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.425 ' HB3' ' CZ2' ' A' ' 8' ' ' TRP . 10.9 mptt -74.68 158.29 33.84 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.304 -0.872 . . . . 0.0 109.452 -179.0 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 79.8 mtp180 -150.92 140.26 21.37 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.246 -0.909 . . . . 0.0 109.456 -179.171 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.589 ' N ' ' CD1' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -167.75 140.88 3.31 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.228 -0.92 . . . . 0.0 109.389 179.213 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -87.68 136.13 33.08 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.168 -0.957 . . . . 0.0 109.465 178.586 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 32.8 m -94.03 141.05 23.16 Favored Pre-proline 0 N--CA 1.489 1.511 0 O-C-N 121.149 -0.969 . . . . 0.0 109.505 -179.701 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -70.27 -14.81 34.89 Favored 'Trans proline' 0 C--N 1.304 -1.773 0 C-N-CA 122.893 2.396 . . . . 0.0 112.249 179.713 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.4 ' HB2' ' SD ' ' A' ' 71' ' ' MET . . . -90.78 -11.71 38.64 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.206 -0.934 . . . . 0.0 109.483 179.835 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 7.7 mp -99.71 148.95 35.46 Favored Pre-proline 0 N--CA 1.49 1.553 0 O-C-N 121.183 -0.948 . . . . 0.0 109.456 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.408 ' HG2' ' CD1' ' A' ' 17' ' ' TRP . 47.2 Cg_endo -70.21 148.88 63.15 Favored 'Trans proline' 0 C--N 1.305 -1.738 0 C-N-CA 122.858 2.372 . . . . 0.0 112.213 178.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -52.97 129.31 30.12 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.313 -0.867 . . . . 0.0 109.52 -179.463 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 122.84 -25.09 6.56 Favored Glycine 0 N--CA 1.489 2.211 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 179.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . 0.434 ' N ' ' CD1' ' A' ' 17' ' ' TRP . 14.1 m95 -86.76 152.11 22.8 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.226 -1.161 . . . . 0.0 109.479 179.652 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -129.48 147.13 51.26 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.165 -0.96 . . . . 0.0 109.545 -179.422 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.553 ' NH1' ' NE1' ' A' ' 8' ' ' TRP . 75.0 ttt-85 -128.23 125.74 39.55 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.231 -0.918 . . . . 0.0 109.432 179.581 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.588 ' OE2' ' CE1' ' A' ' 38' ' ' TYR . 21.8 pt-20 -134.1 139.34 45.87 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.201 -0.937 . . . . 0.0 109.461 -179.553 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -101.55 151.3 22.14 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.278 -0.888 . . . . 0.0 109.4 -179.778 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.1 t -136.14 122.52 13.99 Favored Pre-proline 0 N--CA 1.491 1.578 0 O-C-N 121.226 -0.921 . . . . 0.0 109.518 -179.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.414 ' CB ' ' NH1' ' A' ' 33' ' ' ARG . 62.0 Cg_endo -77.01 140.14 19.88 Favored 'Trans proline' 0 C--N 1.306 -1.689 0 C-N-CA 122.814 2.342 . . . . 0.0 112.109 -178.766 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.456 HH11 ' HB2' ' A' ' 29' ' ' SER . 38.5 ttm180 -89.9 168.04 12.35 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.157 -0.964 . . . . 0.0 109.522 178.5 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.612 ' O ' ' O ' ' A' ' 26' ' ' SER . 90.8 mtm180 -119.06 -139.18 0.35 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.269 -0.894 . . . . 0.0 109.475 -178.832 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.612 ' O ' ' O ' ' A' ' 25' ' ' ARG . 12.6 p -38.14 166.06 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.248 -0.907 . . . . 0.0 109.496 -179.391 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 108.91 153.15 15.56 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 -179.127 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.545 ' C ' ' H ' ' A' ' 30' ' ' ALA . 95.0 mt -59.43 -41.74 90.26 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.33 -1.1 . . . . 0.0 109.458 -179.752 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.456 ' HB2' HH11 ' A' ' 24' ' ' ARG . 2.9 m -70.78 30.38 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.185 -0.947 . . . . 0.0 109.458 178.846 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.545 ' H ' ' C ' ' A' ' 28' ' ' LEU . . . -66.36 150.71 48.46 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.236 -0.915 . . . . 0.0 109.405 -179.77 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 78.65 -17.72 6.49 Favored Glycine 0 N--CA 1.49 2.268 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.676 ' C ' ' HE ' ' A' ' 33' ' ' ARG . 58.4 m80 -71.4 131.73 43.79 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.352 -1.087 . . . . 0.0 109.496 179.773 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.676 ' HE ' ' C ' ' A' ' 32' ' ' HIS . 0.4 OUTLIER -107.49 107.82 18.85 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.252 -0.905 . . . . 0.0 109.481 -179.261 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.511 ' OD1' ' N ' ' A' ' 35' ' ' VAL . 58.4 t0 -77.8 134.94 37.91 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.303 -0.873 . . . . 0.0 109.505 179.41 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.511 ' N ' ' OD1' ' A' ' 34' ' ' ASP . 47.1 t -105.45 128.13 59.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.247 -0.908 . . . . 0.0 109.47 -179.796 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.418 ' CZ ' ' OD2' ' A' ' 34' ' ' ASP . 72.7 m-85 -115.14 142.89 46.05 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.172 -0.955 . . . . 0.0 109.427 179.251 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.409 ' HB2' ' CE2' ' A' ' 45' ' ' PHE . 52.8 m-85 -111.22 142.73 43.03 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.273 -0.892 . . . . 0.0 109.462 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.588 ' CE1' ' OE2' ' A' ' 20' ' ' GLU . 19.9 m-85 -118.14 135.85 53.97 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.251 -0.905 . . . . 0.0 109.445 179.793 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.438 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -94.26 176.88 2.13 Favored Pre-proline 0 N--CA 1.49 1.551 0 O-C-N 121.231 -0.918 . . . . 0.0 109.474 179.55 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.438 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 42.1 Cg_exo -55.47 -29.88 71.07 Favored 'Trans proline' 0 C--N 1.304 -1.795 0 C-N-CA 122.897 2.398 . . . . 0.0 112.243 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 66.8 m -91.05 -2.29 57.67 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.176 -0.952 . . . . 0.0 109.548 -179.396 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 88.32 22.1 42.27 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.556 -1.418 . . . . 0.0 109.556 179.748 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.482 ' HE3' HE22 ' A' ' 50' ' ' GLN . 46.9 tttp -75.06 129.13 37.08 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.273 -1.133 . . . . 0.0 109.421 -179.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 47.5 mtpt -94.27 120.87 35.14 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.263 -0.898 . . . . 0.0 109.531 179.301 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.599 ' N ' ' CD1' ' A' ' 45' ' ' PHE . 2.0 p90 -141.68 150.63 42.13 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.197 -0.939 . . . . 0.0 109.389 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 10.6 ptm180 -143.04 68.94 1.3 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.331 -0.855 . . . . 0.0 109.453 179.194 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -148.1 129.45 14.77 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.179 -0.951 . . . . 0.0 109.439 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.639 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -61.2 -42.95 88.52 Favored Pre-proline 0 N--CA 1.488 1.448 0 O-C-N 121.209 -0.932 . . . . 0.0 109.461 -179.33 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.639 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 32.0 Cg_exo -58.2 -40.26 77.93 Favored 'Trans proline' 0 C--N 1.305 -1.752 0 C-N-CA 122.845 2.363 . . . . 0.0 112.242 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.482 HE22 ' HE3' ' A' ' 43' ' ' LYS . 59.5 tt0 -65.79 -38.86 90.15 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.29 -0.881 . . . . 0.0 109.516 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.443 HD11 ' CE2' ' A' ' 45' ' ' PHE . 8.9 mp -65.29 -45.53 84.04 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.223 -0.923 . . . . 0.0 109.46 -179.667 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.667 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -72.35 -48.08 44.64 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.337 -0.852 . . . . 0.0 109.515 -179.379 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 80.1 mtp180 -58.9 -32.52 69.59 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.203 -0.936 . . . . 0.0 109.473 -179.413 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 24.2 t80 -86.01 -55.08 4.11 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.301 -0.875 . . . . 0.0 109.446 -178.55 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.404 ' O ' ' C ' ' A' ' 56' ' ' GLY . 95.2 mt -93.85 6.2 49.18 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.263 -0.898 . . . . 0.0 109.411 -178.217 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.667 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -45.55 -72.29 0.39 Allowed Glycine 0 N--CA 1.492 2.374 0 N-CA-C 109.475 -1.45 . . . . 0.0 109.475 -179.599 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -57.41 -43.7 93.82 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 -179.016 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 54.1 p -58.2 -34.64 70.59 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.243 -1.151 . . . . 0.0 109.44 -179.344 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.404 ' N ' ' O ' ' A' ' 55' ' ' LEU . 1.7 mmm -170.53 162.82 8.23 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.33 -0.856 . . . . 0.0 109.472 -179.61 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 56.2 t0 -95.42 114.69 26.48 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.238 -0.914 . . . . 0.0 109.499 179.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 97.0 mt -106.67 3.13 26.43 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.277 -0.89 . . . . 0.0 109.501 -179.073 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 78.7 p -52.75 -36.76 58.36 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.263 -0.898 . . . . 0.0 109.408 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 54.3 p -81.17 14.45 2.34 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.273 -0.892 . . . . 0.0 109.457 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.625 ' O ' ' NZ ' ' A' ' 48' ' ' LYS . 47.0 t80 -88.75 133.15 34.33 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.255 -0.903 . . . . 0.0 109.402 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.499 ' O ' ' N ' ' A' ' 69' ' ' GLY . 64.4 t0 -82.87 114.11 20.95 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.299 -0.876 . . . . 0.0 109.48 -179.734 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 64.0 t80 -75.02 -44.89 45.4 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.249 -0.907 . . . . 0.0 109.477 -179.068 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.61 -46.09 84.52 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.314 -0.866 . . . . 0.0 109.459 -179.214 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.534 ' O ' ' NH2' ' A' ' 19' ' ' ARG . 43.3 p -94.71 -13.45 25.74 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.245 -0.91 . . . . 0.0 109.486 -179.836 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.507 ' HA3' ' HE ' ' A' ' 19' ' ' ARG . . . 61.72 40.23 98.5 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 179.732 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -137.75 157.21 46.92 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.267 -1.137 . . . . 0.0 109.468 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.4 ' SD ' ' HB2' ' A' ' 12' ' ' ALA . 3.0 ttt -84.6 122.97 29.8 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.197 -0.939 . . . . 0.0 109.422 -179.684 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 7.2 tt . . . . . 0 N--CA 1.49 1.572 0 O-C-N 121.334 -0.854 . . . . 0.0 109.449 -179.908 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.529 4.88 0 N-CA-C 119.437 2.535 . . . . 0.0 119.437 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.4 m -74.07 150.25 40.68 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.315 -1.109 . . . . 0.0 109.577 179.618 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.442 ' O ' ' C ' ' A' ' 4' ' ' GLU . 66.6 mtt 50.9 -169.8 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.279 -0.888 . . . . 0.0 109.464 -179.951 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.442 ' C ' ' O ' ' A' ' 3' ' ' MET . 83.9 tt0 42.65 88.16 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.348 -0.845 . . . . 0.0 109.446 -179.974 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.425 ' N ' ' OE2' ' A' ' 20' ' ' GLU . 8.3 tpm_? -71.21 -110.3 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.283 -0.886 . . . . 0.0 109.411 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.412 ' N ' ' HG3' ' A' ' 5' ' ' ARG . 7.4 ptmt -115.98 109.81 18.08 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.196 -0.94 . . . . 0.0 109.496 179.465 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -120.88 133.61 55.3 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.22 -0.925 . . . . 0.0 109.493 -179.424 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.444 ' HB2' ' HE ' ' A' ' 19' ' ' ARG . 2.0 m0 -129.82 175.97 8.41 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.232 -0.918 . . . . 0.0 109.502 179.879 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 -75.38 143.39 42.81 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.258 -0.902 . . . . 0.0 109.417 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.2 t -101.93 108.5 56.65 Favored Pre-proline 0 N--CA 1.49 1.575 0 O-C-N 121.259 -0.901 . . . . 0.0 109.448 179.703 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -77.01 -14.99 16.69 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 C-N-CA 122.891 2.394 . . . . 0.0 112.226 -179.223 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -71.39 -40.33 70.62 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.274 -0.891 . . . . 0.0 109.402 -179.746 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.524 ' N ' HD23 ' A' ' 13' ' ' LEU . 0.3 OUTLIER -96.19 -179.59 0.95 Allowed Pre-proline 0 N--CA 1.49 1.527 0 O-C-N 121.236 -0.915 . . . . 0.0 109.433 -179.947 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.517 ' CD ' ' CB ' ' A' ' 13' ' ' LEU . 33.6 Cg_exo -60.34 145.91 97.67 Favored 'Trans proline' 0 C--N 1.306 -1.701 0 C-N-CA 122.786 2.324 . . . . 0.0 112.247 -179.481 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 19.2 mm100 -51.79 128.85 24.94 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.175 -0.953 . . . . 0.0 109.524 -179.821 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 123.96 -24.17 6.41 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.626 -1.39 . . . . 0.0 109.626 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 31.0 m95 -84.16 145.91 28.13 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.28 -1.129 . . . . 0.0 109.483 179.308 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -138.42 154.93 48.89 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.228 -0.92 . . . . 0.0 109.527 -179.458 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.598 ' H ' ' CD ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -126.59 162.17 26.32 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.294 -0.879 . . . . 0.0 109.474 179.252 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.425 ' OE2' ' N ' ' A' ' 5' ' ' ARG . 78.0 tt0 -143.22 144.55 32.2 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.219 -0.925 . . . . 0.0 109.48 -179.004 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -113.07 132.68 55.32 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.192 -0.942 . . . . 0.0 109.387 179.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.5 t -127.53 108.95 20.89 Favored Pre-proline 0 N--CA 1.491 1.589 0 O-C-N 121.217 -0.927 . . . . 0.0 109.609 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -74.53 142.72 29.84 Favored 'Trans proline' 0 C--N 1.305 -1.713 0 C-N-CA 122.811 2.341 . . . . 0.0 112.127 -178.557 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.414 ' NE ' ' OG ' ' A' ' 29' ' ' SER . 80.6 mtp85 -97.78 172.27 7.79 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.189 -0.944 . . . . 0.0 109.448 179.059 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.482 ' O ' ' OG ' ' A' ' 26' ' ' SER . 59.8 ttp180 -174.44 62.88 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.252 -0.905 . . . . 0.0 109.476 -179.416 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.482 ' OG ' ' O ' ' A' ' 25' ' ' ARG . 1.6 m 168.32 78.75 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.206 -0.934 . . . . 0.0 109.516 179.25 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 143.54 178.87 19.7 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 179.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.547 ' C ' ' H ' ' A' ' 30' ' ' ALA . 3.9 mm? -60.61 -40.4 91.73 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.303 -1.116 . . . . 0.0 109.435 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.414 ' OG ' ' NE ' ' A' ' 24' ' ' ARG . 78.9 p -70.39 29.67 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.267 -0.896 . . . . 0.0 109.422 179.805 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.547 ' H ' ' C ' ' A' ' 28' ' ' LEU . . . -66.35 146.73 54.25 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.26 -0.9 . . . . 0.0 109.455 179.703 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 78.95 -14.83 12.02 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 78.5 m80 -86.11 130.74 34.43 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.215 -1.168 . . . . 0.0 109.375 179.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 36.2 ptt-85 -112.26 132.77 54.76 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.203 -0.935 . . . . 0.0 109.56 -179.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -87.88 142.24 27.96 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.266 -0.896 . . . . 0.0 109.475 179.289 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 59.6 t -112.72 125.74 70.02 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.317 -0.865 . . . . 0.0 109.496 179.91 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 84.0 m-85 -112.98 144.28 42.83 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.238 -0.913 . . . . 0.0 109.518 179.11 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.668 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 49.9 m-85 -112.71 148.46 34.66 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.233 -0.917 . . . . 0.0 109.455 -179.786 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.569 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 3.1 m-85 -127.88 140.37 52.06 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.312 -0.867 . . . . 0.0 109.609 -179.934 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.431 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -96.21 176.64 2.07 Favored Pre-proline 0 N--CA 1.491 1.606 0 O-C-N 121.214 -0.929 . . . . 0.0 109.467 179.775 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.431 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 53.1 Cg_exo -54.29 -30.13 60.86 Favored 'Trans proline' 0 C--N 1.305 -1.728 0 C-N-CA 122.797 2.332 . . . . 0.0 112.252 179.568 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 11.7 t -88.0 -3.27 58.93 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.248 -0.908 . . . . 0.0 109.477 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 87.61 21.97 45.39 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.549 -1.421 . . . . 0.0 109.549 -179.673 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 61.6 tttp -73.57 123.76 24.59 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.306 -1.114 . . . . 0.0 109.452 -179.668 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -90.8 121.59 32.8 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.267 -0.895 . . . . 0.0 109.443 179.331 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.447 ' CD1' ' N ' ' A' ' 45' ' ' PHE . 8.9 p90 -141.07 148.17 39.75 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.21 -0.931 . . . . 0.0 109.511 179.763 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -142.31 70.61 1.33 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.207 -0.933 . . . . 0.0 109.49 179.137 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.432 ' O ' HD23 ' A' ' 51' ' ' LEU . 1.5 p -158.67 144.44 16.68 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.296 -0.877 . . . . 0.0 109.423 179.575 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.675 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 12.9 tptt -65.46 -41.71 52.19 Favored Pre-proline 0 N--CA 1.49 1.547 0 O-C-N 121.316 -0.865 . . . . 0.0 109.455 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.675 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 39.0 Cg_exo -57.23 -40.35 83.22 Favored 'Trans proline' 0 C--N 1.306 -1.699 0 C-N-CA 122.839 2.36 . . . . 0.0 112.259 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -68.22 -39.1 82.45 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.202 -0.936 . . . . 0.0 109.46 179.747 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.432 HD23 ' O ' ' A' ' 47' ' ' SER . 4.0 mm? -61.92 -46.34 89.79 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.253 -0.904 . . . . 0.0 109.457 -179.504 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.633 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -73.9 -42.81 60.11 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.339 -0.851 . . . . 0.0 109.452 -179.361 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 75.7 ttt180 -58.59 -47.32 84.72 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.296 -0.877 . . . . 0.0 109.515 -179.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 18.4 t80 -69.8 -53.88 16.19 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.222 -0.924 . . . . 0.0 109.479 -179.454 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.438 ' O ' ' N ' ' A' ' 57' ' ' GLY . 96.0 mt -80.35 0.39 33.27 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.288 -0.883 . . . . 0.0 109.45 -179.142 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.633 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -56.98 89.72 0.01 OUTLIER Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . 0.438 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . 133.18 -1.08 4.49 Favored Glycine 0 N--CA 1.491 2.346 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 -179.885 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 32.2 t -105.23 -31.02 9.3 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.27 -1.135 . . . . 0.0 109.457 179.786 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 3.1 ptp -178.71 176.75 0.94 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.33 -0.856 . . . . 0.0 109.512 -179.831 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -85.86 104.64 15.71 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.214 -0.929 . . . . 0.0 109.436 179.462 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -85.98 -0.89 56.62 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.162 -0.961 . . . . 0.0 109.453 -179.662 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 40.9 t -53.67 -37.64 63.38 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.157 -0.964 . . . . 0.0 109.442 -179.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . 0.51 ' O ' ' SD ' ' A' ' 71' ' ' MET . 37.8 p -95.23 45.68 1.1 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.207 -0.933 . . . . 0.0 109.43 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 26.3 t80 -121.26 129.86 53.37 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.259 -0.901 . . . . 0.0 109.478 -179.69 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.454 ' O ' ' N ' ' A' ' 69' ' ' GLY . 57.9 t0 -90.2 110.17 21.22 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.266 -0.897 . . . . 0.0 109.418 -179.974 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.668 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 74.6 t80 -77.19 -40.27 45.86 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.233 -0.917 . . . . 0.0 109.445 -179.915 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 26.6 mmt180 -61.07 -39.31 89.4 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.23 -0.919 . . . . 0.0 109.53 -179.609 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.443 ' OG1' ' CG ' ' A' ' 65' ' ' ASP . 34.6 p -100.35 -15.45 17.98 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.27 -0.894 . . . . 0.0 109.516 -179.528 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.454 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 64.21 42.64 97.84 Favored Glycine 0 N--CA 1.491 2.336 0 N-CA-C 109.542 -1.423 . . . . 0.0 109.542 179.661 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.5 tppt? -135.9 143.46 45.01 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.24 -1.153 . . . . 0.0 109.468 179.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.51 ' SD ' ' O ' ' A' ' 63' ' ' THR . 35.8 tpp -85.23 131.72 34.38 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.244 -0.91 . . . . 0.0 109.5 -179.616 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.566 ' C ' HD23 ' A' ' 72' ' ' LEU . 4.4 tt . . . . . 0 N--CA 1.491 1.588 0 O-C-N 121.177 -0.952 . . . . 0.0 109.442 -179.761 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.528 4.819 0 N-CA-C 119.494 2.557 . . . . 0.0 119.494 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 60.72 9.22 2.08 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.187 -1.184 . . . . 0.0 109.397 179.593 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.475 ' O ' ' N ' ' A' ' 5' ' ' ARG . 26.3 ttt -68.72 101.13 1.26 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.336 -0.853 . . . . 0.0 109.438 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.459 ' C ' ' O ' ' A' ' 3' ' ' MET . 69.9 mm-40 41.12 27.61 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.285 -0.884 . . . . 0.0 109.48 -179.8 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.475 ' N ' ' O ' ' A' ' 3' ' ' MET . 62.9 ttp180 -151.93 102.11 2.8 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.288 -0.883 . . . . 0.0 109.43 -179.876 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 56.7 mttt -74.12 163.27 28.07 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.202 -0.936 . . . . 0.0 109.481 179.882 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.589 ' O ' ' CD1' ' A' ' 8' ' ' TRP . 15.0 mmt180 -142.38 134.03 26.78 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.248 -0.907 . . . . 0.0 109.499 -178.617 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.589 ' CD1' ' O ' ' A' ' 7' ' ' ARG . 5.8 m0 -159.62 132.81 6.95 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.147 -0.97 . . . . 0.0 109.477 179.831 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -73.62 148.55 42.76 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.251 -0.906 . . . . 0.0 109.465 179.286 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.433 ' SG ' HD13 ' A' ' 13' ' ' LEU . 34.1 t -112.69 100.99 52.11 Favored Pre-proline 0 N--CA 1.488 1.448 0 O-C-N 121.236 -0.915 . . . . 0.0 109.523 -179.585 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_exo -54.2 -29.14 55.18 Favored 'Trans proline' 0 C--N 1.306 -1.705 0 C-N-CA 122.885 2.39 . . . . 0.0 112.204 179.092 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.591 ' HB2' ' HG3' ' A' ' 71' ' ' MET . . . -66.25 -24.53 66.6 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.334 -0.854 . . . . 0.0 109.502 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.571 ' CD1' ' N ' ' A' ' 13' ' ' LEU . 4.8 mp -96.1 155.84 37.76 Favored Pre-proline 0 N--CA 1.489 1.519 0 O-C-N 121.263 -0.898 . . . . 0.0 109.542 -179.841 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.675 ' HG3' HD11 ' A' ' 55' ' ' LEU . 37.7 Cg_exo -59.34 143.8 99.61 Favored 'Trans proline' 0 C--N 1.305 -1.719 0 C-N-CA 122.799 2.333 . . . . 0.0 112.182 179.273 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 70.5 tp60 -47.81 129.44 14.2 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.278 -0.889 . . . . 0.0 109.491 179.601 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 119.24 -21.9 9.16 Favored Glycine 0 N--CA 1.489 2.214 0 N-CA-C 109.576 -1.409 . . . . 0.0 109.576 -179.317 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . 0.41 ' N ' ' CD1' ' A' ' 17' ' ' TRP . 15.9 m95 -83.73 151.35 25.28 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.219 -1.165 . . . . 0.0 109.456 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -128.94 146.05 51.06 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.239 -0.913 . . . . 0.0 109.472 -179.394 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.533 ' NH2' HG11 ' A' ' 35' ' ' VAL . 77.8 ttt-85 -127.86 123.87 36.12 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.242 -0.911 . . . . 0.0 109.478 178.853 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.543 ' OE1' ' CZ ' ' A' ' 7' ' ' ARG . 7.2 pt-20 -131.37 138.92 49.35 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.254 -0.903 . . . . 0.0 109.529 -179.834 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 46.0 tt0 -94.39 143.95 25.97 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.333 -0.854 . . . . 0.0 109.423 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.411 HG13 ' HD2' ' A' ' 23' ' ' PRO . 47.3 t -126.5 135.56 27.41 Favored Pre-proline 0 N--CA 1.49 1.552 0 O-C-N 121.206 -0.933 . . . . 0.0 109.606 -179.257 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.429 ' O ' ' N ' ' A' ' 25' ' ' ARG . 34.9 Cg_endo -65.58 152.21 82.47 Favored 'Trans proline' 0 C--N 1.304 -1.772 0 C-N-CA 122.828 2.352 . . . . 0.0 112.214 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.511 ' CZ ' ' O ' ' A' ' 24' ' ' ARG . 0.6 OUTLIER -59.86 87.88 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.258 -0.901 . . . . 0.0 109.504 -178.992 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.429 ' N ' ' O ' ' A' ' 23' ' ' PRO . 79.5 mtp85 -99.96 103.78 15.36 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.253 -0.904 . . . . 0.0 109.453 178.109 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 4.6 t 63.49 139.7 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.189 -0.944 . . . . 0.0 109.463 -179.767 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 137.97 145.88 4.95 Favored Glycine 0 N--CA 1.489 2.173 0 N-CA-C 109.605 -1.398 . . . . 0.0 109.605 -179.778 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 97.6 mt -72.47 -48.34 41.6 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.229 -1.159 . . . . 0.0 109.48 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.532 ' O ' ' O ' ' A' ' 30' ' ' ALA . 4.4 m -72.03 0.6 9.04 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.253 -0.904 . . . . 0.0 109.496 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.532 ' O ' ' O ' ' A' ' 29' ' ' SER . . . -42.5 170.43 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.297 -0.877 . . . . 0.0 109.519 179.755 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.452 ' H ' ' HD2' ' A' ' 24' ' ' ARG . . . 123.53 -22.37 6.98 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 -179.63 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 74.0 m80 -127.52 -162.27 1.15 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.294 -1.121 . . . . 0.0 109.489 179.37 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 84.8 mtt85 -111.62 128.05 55.93 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.228 -0.92 . . . . 0.0 109.461 179.818 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 97.1 m-20 -91.37 140.28 29.92 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.135 -0.978 . . . . 0.0 109.461 -179.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.533 HG11 ' NH2' ' A' ' 19' ' ' ARG . 21.5 t -106.08 132.85 52.13 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.272 -0.893 . . . . 0.0 109.436 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.526 ' CD1' ' NZ ' ' A' ' 44' ' ' LYS . 78.4 m-85 -120.96 142.23 49.94 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.299 -0.876 . . . . 0.0 109.444 179.634 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -112.31 146.36 38.39 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.299 -0.876 . . . . 0.0 109.536 -179.642 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 87.7 m-85 -126.49 139.98 52.81 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.176 -0.953 . . . . 0.0 109.529 179.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.412 ' CB ' ' HD2' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -100.44 165.18 14.87 Favored Pre-proline 0 N--CA 1.489 1.502 0 O-C-N 121.223 -0.923 . . . . 0.0 109.418 179.644 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.412 ' HD2' ' CB ' ' A' ' 39' ' ' SER . 18.8 Cg_endo -58.81 -19.37 46.43 Favored 'Trans proline' 0 C--N 1.306 -1.685 0 C-N-CA 122.783 2.322 . . . . 0.0 112.258 179.705 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 3.0 p -89.98 -0.91 57.84 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.291 -0.88 . . . . 0.0 109.433 179.725 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 86.61 14.65 65.17 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.506 -1.438 . . . . 0.0 109.506 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -80.35 117.42 21.09 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.296 -1.12 . . . . 0.0 109.511 -179.633 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.526 ' NZ ' ' CD1' ' A' ' 36' ' ' PHE . 61.5 tttm -92.57 128.86 38.58 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.297 -0.877 . . . . 0.0 109.396 178.765 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.624 ' N ' ' CD1' ' A' ' 45' ' ' PHE . 1.0 OUTLIER -139.71 147.25 40.66 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.222 -0.924 . . . . 0.0 109.457 -179.716 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.623 ' O ' ' NE ' ' A' ' 46' ' ' ARG . 0.6 OUTLIER -137.36 62.12 1.6 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.161 -0.962 . . . . 0.0 109.53 179.635 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -150.14 133.34 16.31 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.306 -0.871 . . . . 0.0 109.433 179.871 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.599 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 1.1 tmtp? -55.42 -46.79 99.65 Favored Pre-proline 0 N--CA 1.491 1.59 0 O-C-N 121.238 -0.913 . . . . 0.0 109.437 -179.599 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.599 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 51.8 Cg_exo -53.7 -35.28 77.56 Favored 'Trans proline' 0 C--N 1.306 -1.685 0 C-N-CA 122.813 2.342 . . . . 0.0 112.234 -179.799 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.581 ' OE1' ' NH2' ' A' ' 53' ' ' ARG . 3.6 mm100 -67.09 -36.85 82.86 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.246 -0.909 . . . . 0.0 109.554 179.821 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.475 ' CD2' ' N ' ' A' ' 51' ' ' LEU . 3.8 mm? -66.4 -53.9 30.56 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.153 -0.967 . . . . 0.0 109.457 -179.046 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.617 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -66.97 -47.7 70.77 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.331 -0.855 . . . . 0.0 109.511 -178.521 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.581 ' NH2' ' OE1' ' A' ' 50' ' ' GLN . 57.3 ttp180 -59.21 -45.06 92.11 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.278 -0.889 . . . . 0.0 109.463 -178.839 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -69.7 -54.48 13.6 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.334 -0.854 . . . . 0.0 109.468 -179.211 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.675 HD11 ' HG3' ' A' ' 14' ' ' PRO . 1.8 mm? -80.42 -0.58 37.74 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.271 -0.893 . . . . 0.0 109.487 -179.462 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.919 ' O ' ' N ' ' A' ' 58' ' ' SER . . . -51.39 -176.13 0.03 OUTLIER Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.514 -1.434 . . . . 0.0 109.514 179.641 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 43.9 -69.81 0.0 OUTLIER Glycine 0 N--CA 1.491 2.337 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.919 ' N ' ' O ' ' A' ' 56' ' ' GLY . 82.8 p -57.72 -30.89 65.91 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.29 -1.123 . . . . 0.0 109.441 -178.244 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.443 ' O ' ' O ' ' A' ' 55' ' ' LEU . 1.3 mmm -167.29 160.19 13.33 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.209 -0.932 . . . . 0.0 109.493 -179.419 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 45.2 t0 -109.59 129.08 55.61 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.201 -0.937 . . . . 0.0 109.441 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 94.4 mt -114.65 16.12 17.55 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.193 -0.942 . . . . 0.0 109.427 -179.173 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 12.0 t -58.03 -38.04 75.48 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.257 -0.902 . . . . 0.0 109.462 179.825 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 17.9 p -87.9 19.62 3.46 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.266 -0.896 . . . . 0.0 109.5 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 60.0 t80 -88.52 132.38 34.53 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.213 -0.929 . . . . 0.0 109.458 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.51 ' HB2' HD23 ' A' ' 72' ' ' LEU . 60.1 t0 -83.43 111.51 19.1 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.356 -0.84 . . . . 0.0 109.454 -179.39 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 15.6 t80 -76.63 -39.93 50.85 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.256 -0.903 . . . . 0.0 109.517 -179.792 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.548 ' NE ' ' H ' ' A' ' 67' ' ' ARG . 0.2 OUTLIER -63.83 -42.29 97.65 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.182 -0.949 . . . . 0.0 109.575 -179.16 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.447 ' OG1' ' OD2' ' A' ' 65' ' ' ASP . 27.5 p -98.43 -12.47 21.34 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.317 -0.864 . . . . 0.0 109.591 -179.359 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.445 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 63.21 39.87 98.41 Favored Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.526 -1.43 . . . . 0.0 109.526 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.479 ' H ' ' HB3' ' A' ' 65' ' ' ASP . 68.6 mttm -140.3 157.76 45.07 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.154 -1.204 . . . . 0.0 109.453 -179.523 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.591 ' HG3' ' HB2' ' A' ' 12' ' ' ALA . 68.4 mtp -86.02 132.21 34.1 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.257 -0.902 . . . . 0.0 109.556 179.805 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.51 HD23 ' HB2' ' A' ' 65' ' ' ASP . 4.0 mm? . . . . . 0 N--CA 1.491 1.612 0 O-C-N 121.301 -0.874 . . . . 0.0 109.472 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.528 4.799 0 N-CA-C 119.396 2.519 . . . . 0.0 119.396 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.426 ' O ' ' N ' ' A' ' 4' ' ' GLU . 4.0 p -89.52 4.67 48.49 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.25 -1.147 . . . . 0.0 109.535 179.693 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 99.8 mmm -70.98 52.06 0.15 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.338 -0.851 . . . . 0.0 109.42 -179.775 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.426 ' N ' ' O ' ' A' ' 2' ' ' SER . 24.2 tt0 66.46 15.07 10.0 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.172 -0.955 . . . . 0.0 109.508 179.623 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.6 mtt85 -163.68 112.56 1.24 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.324 -0.86 . . . . 0.0 109.411 179.534 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.425 ' HB2' ' CZ2' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -121.84 113.64 19.93 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.318 -0.863 . . . . 0.0 109.441 -179.86 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.492 ' CD ' ' C ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -102.86 123.17 46.0 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.22 -0.925 . . . . 0.0 109.462 179.849 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.425 ' CZ2' ' HB2' ' A' ' 6' ' ' LYS . 7.7 m0 -125.76 175.21 7.78 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.284 -0.885 . . . . 0.0 109.458 179.844 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 31.2 tp10 -81.15 155.12 26.37 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.271 -0.893 . . . . 0.0 109.526 179.686 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.554 ' SG ' ' N ' ' A' ' 19' ' ' ARG . 3.4 m -114.3 100.51 52.95 Favored Pre-proline 0 N--CA 1.49 1.562 0 O-C-N 121.29 -0.881 . . . . 0.0 109.395 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -53.64 -38.04 84.01 Favored 'Trans proline' 0 C--N 1.305 -1.727 0 C-N-CA 122.879 2.386 . . . . 0.0 112.255 179.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.0 -39.5 78.43 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.225 -0.922 . . . . 0.0 109.529 -179.522 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.574 ' CD2' ' N ' ' A' ' 13' ' ' LEU . 2.5 mm? -91.63 155.78 43.53 Favored Pre-proline 0 N--CA 1.489 1.499 0 O-C-N 121.2 -0.937 . . . . 0.0 109.546 179.896 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -55.59 160.27 9.62 Favored 'Trans proline' 0 C--N 1.303 -1.819 0 C-N-CA 122.905 2.403 . . . . 0.0 112.228 -179.591 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 59.3 tt0 -54.63 125.32 19.34 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.206 -0.934 . . . . 0.0 109.466 -179.166 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 125.23 -20.99 6.54 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.601 -1.4 . . . . 0.0 109.601 179.259 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . 0.401 ' CG ' ' HB3' ' A' ' 13' ' ' LEU . 34.9 m95 -89.59 140.9 29.09 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.196 -1.179 . . . . 0.0 109.488 178.875 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.577 ' OE1' ' N ' ' A' ' 18' ' ' GLU . 54.5 mp0 -135.8 152.8 51.46 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.269 -0.895 . . . . 0.0 109.508 -179.09 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.554 ' N ' ' SG ' ' A' ' 10' ' ' CYS . 4.8 ptm85 -118.52 161.24 20.35 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.269 -0.894 . . . . 0.0 109.428 178.82 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.564 ' O ' HG13 ' A' ' 35' ' ' VAL . 79.1 tt0 -143.05 137.43 29.22 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.208 -0.932 . . . . 0.0 109.5 -179.351 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.427 ' HG2' HG22 ' A' ' 35' ' ' VAL . 99.2 mt-10 -110.91 131.0 55.42 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.241 -0.912 . . . . 0.0 109.334 -179.803 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.9 t -136.1 123.27 14.5 Favored Pre-proline 0 N--CA 1.49 1.528 0 O-C-N 121.165 -0.959 . . . . 0.0 109.549 -179.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -75.76 135.51 17.8 Favored 'Trans proline' 0 C--N 1.304 -1.791 0 C-N-CA 122.816 2.344 . . . . 0.0 112.209 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.45 ' HG2' ' H ' ' A' ' 25' ' ' ARG . 35.8 ttm180 -92.41 169.78 10.29 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.237 -0.914 . . . . 0.0 109.429 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.45 ' H ' ' HG2' ' A' ' 24' ' ' ARG . 90.3 mtm-85 -126.47 125.09 41.52 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.157 -0.964 . . . . 0.0 109.544 179.568 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.469 ' O ' ' HB2' ' A' ' 30' ' ' ALA . 14.0 t -168.63 159.06 9.75 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.265 -0.897 . . . . 0.0 109.427 -179.907 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -66.09 -86.76 0.07 OUTLIER Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.55 -1.42 . . . . 0.0 109.55 -179.65 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.628 ' H ' HD23 ' A' ' 28' ' ' LEU . 0.1 OUTLIER -69.3 -34.13 74.23 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.262 -1.14 . . . . 0.0 109.426 -179.317 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.1 m -78.73 14.62 1.26 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.23 -0.919 . . . . 0.0 109.421 -179.467 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.469 ' HB2' ' O ' ' A' ' 26' ' ' SER . . . -59.11 148.68 30.35 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.193 -0.942 . . . . 0.0 109.379 179.849 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 90.02 -16.15 57.75 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 179.732 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 19.1 m170 -59.95 111.63 1.55 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.328 -1.101 . . . . 0.0 109.441 179.796 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 62.4 ttp180 -114.14 126.19 54.8 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.28 -0.888 . . . . 0.0 109.419 -179.642 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.505 ' O ' ' OD1' ' A' ' 34' ' ' ASP . 3.5 p30 -107.25 141.46 38.52 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.224 -0.923 . . . . 0.0 109.403 -179.827 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.564 HG13 ' O ' ' A' ' 20' ' ' GLU . 35.1 t -114.89 131.91 65.68 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.143 -0.973 . . . . 0.0 109.426 -179.817 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -106.57 148.32 28.4 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.287 -0.883 . . . . 0.0 109.409 179.497 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.574 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 63.4 m-85 -116.1 147.18 41.58 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.302 -0.874 . . . . 0.0 109.439 -179.396 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -129.39 143.03 50.68 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.228 -0.92 . . . . 0.0 109.491 -179.446 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.429 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -97.88 176.57 1.98 Allowed Pre-proline 0 N--CA 1.491 1.575 0 O-C-N 121.347 -0.846 . . . . 0.0 109.428 179.784 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.429 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 48.6 Cg_exo -54.46 -28.53 54.83 Favored 'Trans proline' 0 C--N 1.305 -1.74 0 C-N-CA 122.888 2.392 . . . . 0.0 112.227 179.632 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 95.0 p -89.67 0.68 56.8 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.241 -0.912 . . . . 0.0 109.475 179.781 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 83.91 17.75 64.77 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 -179.681 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 61.0 tttp -70.5 122.58 19.95 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.25 -1.147 . . . . 0.0 109.479 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 63.7 tttm -92.39 125.83 37.22 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.222 -0.924 . . . . 0.0 109.531 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.591 ' HE2' HD21 ' A' ' 51' ' ' LEU . 3.3 p90 -140.32 146.99 39.2 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.225 -0.922 . . . . 0.0 109.466 -179.693 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 46' ' ' ARG . 6.3 ptm85 -139.31 59.28 1.61 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.359 -0.838 . . . . 0.0 109.433 179.138 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.3 m -152.38 131.84 12.96 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.188 -0.945 . . . . 0.0 109.52 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.614 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 3.2 tmtp? -61.2 -45.39 95.54 Favored Pre-proline 0 N--CA 1.489 1.505 0 O-C-N 121.221 -0.924 . . . . 0.0 109.413 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.614 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 42.7 Cg_exo -55.69 -43.39 58.04 Favored 'Trans proline' 0 C--N 1.305 -1.747 0 C-N-CA 122.807 2.338 . . . . 0.0 112.224 179.58 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -65.02 -36.46 84.46 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.229 -0.919 . . . . 0.0 109.542 179.408 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.591 HD21 ' HE2' ' A' ' 45' ' ' PHE . 15.1 mt -62.11 -44.29 96.97 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.32 -0.863 . . . . 0.0 109.491 -179.829 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.708 ' O ' ' N ' ' A' ' 56' ' ' GLY . . . -77.2 -46.61 22.71 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.223 -0.923 . . . . 0.0 109.502 -179.865 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 14.1 tpp180 -54.15 -26.57 28.42 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.152 -0.967 . . . . 0.0 109.505 -179.519 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 68.1 t80 -97.59 -53.39 3.45 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.295 -0.878 . . . . 0.0 109.519 -179.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.424 ' C ' ' H ' ' A' ' 57' ' ' GLY . 3.4 tp -106.93 -4.6 18.94 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.197 -0.939 . . . . 0.0 109.497 -178.005 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.708 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -61.61 -2.38 3.32 Favored Glycine 0 N--CA 1.489 2.213 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 -179.789 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . 0.424 ' H ' ' C ' ' A' ' 55' ' ' LEU . . . -99.17 -52.18 1.27 Allowed Glycine 0 N--CA 1.491 2.318 0 N-CA-C 109.526 -1.429 . . . . 0.0 109.526 -179.842 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 9.3 m -77.86 -10.43 59.56 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.265 -1.138 . . . . 0.0 109.524 179.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 52.1 ttm -159.19 152.07 21.94 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.222 -0.924 . . . . 0.0 109.483 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.477 ' OD1' ' OG ' ' A' ' 62' ' ' SER . 59.6 t0 -91.27 110.82 22.12 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.253 -0.904 . . . . 0.0 109.476 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.567 ' N ' HD22 ' A' ' 61' ' ' LEU . 3.8 mm? -93.72 -1.07 55.62 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.334 -0.854 . . . . 0.0 109.445 -179.929 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.477 ' OG ' ' OD1' ' A' ' 60' ' ' ASP . 94.1 p -57.63 -37.47 73.37 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.265 -0.897 . . . . 0.0 109.55 179.609 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 48.3 p -91.75 10.15 29.59 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.196 -0.94 . . . . 0.0 109.549 -179.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -87.51 132.7 33.94 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.204 -0.935 . . . . 0.0 109.487 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.478 ' CG ' ' OG1' ' A' ' 68' ' ' THR . 55.3 t0 -85.49 110.81 19.45 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.298 -0.876 . . . . 0.0 109.543 -179.835 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.574 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 81.7 t80 -77.2 -41.32 41.85 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.269 -0.895 . . . . 0.0 109.482 -179.402 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 16.5 tpp180 -63.19 -42.53 99.35 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.265 -0.897 . . . . 0.0 109.501 -179.177 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.478 ' OG1' ' CG ' ' A' ' 65' ' ' ASP . 25.5 p -96.22 -13.4 23.48 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.297 -0.877 . . . . 0.0 109.473 -179.529 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.409 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 62.54 41.87 99.75 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.415 -1.474 . . . . 0.0 109.415 179.731 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.436 ' H ' ' HB3' ' A' ' 65' ' ' ASP . 98.5 mttt -134.54 147.87 50.39 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.222 -1.164 . . . . 0.0 109.43 -179.717 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 34.2 ttm -89.86 125.17 35.23 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.217 -0.927 . . . . 0.0 109.561 -179.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 2.3 pp . . . . . 0 N--CA 1.489 1.52 0 O-C-N 121.223 -0.923 . . . . 0.0 109.519 179.833 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.528 4.782 0 N-CA-C 119.323 2.489 . . . . 0.0 119.323 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 83.0 p -166.57 127.2 1.65 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.243 -1.151 . . . . 0.0 109.443 179.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 7.8 ptp -85.3 122.41 29.43 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.3 -0.875 . . . . 0.0 109.391 179.836 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 -97.89 144.0 27.9 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.295 -0.878 . . . . 0.0 109.479 179.853 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.443 ' HB3' HG22 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -72.38 171.7 11.74 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.208 -0.932 . . . . 0.0 109.443 179.861 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.621 ' NZ ' ' O ' ' A' ' 21' ' ' GLU . 0.3 OUTLIER -115.61 110.39 19.13 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.207 -0.933 . . . . 0.0 109.493 179.864 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 86.3 mtm180 -93.5 112.37 24.26 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.365 -0.834 . . . . 0.0 109.483 -179.819 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 11.9 m0 -105.26 160.16 15.32 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.267 -0.896 . . . . 0.0 109.376 179.355 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -77.2 139.4 39.88 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.179 -0.95 . . . . 0.0 109.455 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.541 ' SG ' HD23 ' A' ' 13' ' ' LEU . 2.4 t -106.12 102.49 40.09 Favored Pre-proline 0 N--CA 1.49 1.528 0 O-C-N 121.269 -0.894 . . . . 0.0 109.548 179.309 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -72.48 -13.26 27.6 Favored 'Trans proline' 0 C--N 1.304 -1.764 0 C-N-CA 122.838 2.359 . . . . 0.0 112.265 -178.521 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.572 ' C ' HD22 ' A' ' 13' ' ' LEU . . . -82.65 -20.11 36.91 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.181 -0.949 . . . . 0.0 109.494 -179.682 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.673 HD22 ' N ' ' A' ' 13' ' ' LEU . 3.8 mm? -101.13 157.93 32.74 Favored Pre-proline 0 N--CA 1.49 1.55 0 O-C-N 121.222 -0.924 . . . . 0.0 109.465 -179.873 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -52.69 144.67 41.99 Favored 'Trans proline' 0 C--N 1.305 -1.742 0 C-N-CA 122.804 2.336 . . . . 0.0 112.188 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -47.19 123.33 5.33 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.281 -0.887 . . . . 0.0 109.445 -179.524 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 124.02 -21.77 6.9 Favored Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.647 -1.381 . . . . 0.0 109.647 179.67 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . 0.406 ' CZ3' ' CZ ' ' A' ' 45' ' ' PHE . 21.3 m95 -85.42 146.68 26.86 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.225 -1.162 . . . . 0.0 109.439 179.505 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -132.13 149.32 52.43 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.194 -0.941 . . . . 0.0 109.451 -179.554 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.547 ' HE ' HG11 ' A' ' 35' ' ' VAL . 77.7 ttt-85 -114.92 157.44 23.36 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.188 -0.945 . . . . 0.0 109.497 179.416 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.673 ' OE1' HG23 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -152.5 153.68 33.97 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.248 -0.908 . . . . 0.0 109.494 -179.092 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.621 ' O ' ' NZ ' ' A' ' 6' ' ' LYS . 79.2 tt0 -119.5 131.28 55.54 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.331 -0.856 . . . . 0.0 109.338 179.318 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.673 HG23 ' OE1' ' A' ' 20' ' ' GLU . 7.6 t -130.28 125.35 21.75 Favored Pre-proline 0 N--CA 1.489 1.517 0 O-C-N 121.218 -0.926 . . . . 0.0 109.6 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -73.76 122.63 7.91 Favored 'Trans proline' 0 C--N 1.304 -1.81 0 C-N-CA 122.804 2.336 . . . . 0.0 112.156 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.746 ' HE ' ' H ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -77.44 157.98 30.24 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.199 -0.938 . . . . 0.0 109.473 -179.716 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.746 ' H ' ' HE ' ' A' ' 24' ' ' ARG . 17.5 ptm180 -142.79 144.63 32.66 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.208 -0.933 . . . . 0.0 109.521 -179.602 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -179.17 -67.93 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.244 -0.91 . . . . 0.0 109.438 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 177.73 -84.87 0.07 OUTLIER Glycine 0 N--CA 1.489 2.219 0 N-CA-C 109.591 -1.403 . . . . 0.0 109.591 -179.709 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 98.0 mt -62.64 -41.83 99.26 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.279 -1.13 . . . . 0.0 109.441 179.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 6.4 p -100.7 29.98 4.22 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.251 -0.906 . . . . 0.0 109.479 179.326 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -72.27 110.67 6.87 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.362 -0.836 . . . . 0.0 109.418 -179.738 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 123.33 -6.54 9.25 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 13.4 m170 -60.89 152.46 27.36 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.301 -1.117 . . . . 0.0 109.406 179.348 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 38.2 mmm-85 -112.27 109.07 18.52 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.254 -0.904 . . . . 0.0 109.508 -179.395 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -94.22 141.13 28.91 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.193 -0.942 . . . . 0.0 109.39 179.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.547 HG11 ' HE ' ' A' ' 19' ' ' ARG . 49.0 t -107.32 132.11 55.65 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.282 -0.887 . . . . 0.0 109.4 -179.152 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 -122.4 145.88 47.86 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.208 -0.933 . . . . 0.0 109.469 178.598 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.672 ' CE1' ' CE1' ' A' ' 66' ' ' PHE . 63.6 m-85 -119.02 151.52 38.07 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.311 -0.868 . . . . 0.0 109.382 -179.275 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 47.3 m-85 -123.7 139.9 53.53 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.187 -0.946 . . . . 0.0 109.518 179.638 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.451 ' CB ' ' CD ' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -95.37 177.28 1.85 Allowed Pre-proline 0 N--CA 1.49 1.561 0 O-C-N 121.33 -0.856 . . . . 0.0 109.539 179.178 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.451 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 48.3 Cg_exo -54.33 -29.21 56.9 Favored 'Trans proline' 0 C--N 1.304 -1.763 0 C-N-CA 122.838 2.359 . . . . 0.0 112.116 179.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 20.9 t -90.46 -1.55 57.9 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.251 -0.906 . . . . 0.0 109.499 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 86.46 22.51 47.12 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 75.5 tttt -75.42 127.17 32.52 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.193 -1.181 . . . . 0.0 109.453 -179.721 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.443 ' O ' ' HG3' ' A' ' 44' ' ' LYS . 21.3 ptmt -93.0 124.79 37.22 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.247 -0.908 . . . . 0.0 109.477 179.382 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.592 ' CE2' HD11 ' A' ' 51' ' ' LEU . 3.6 p90 -141.87 150.53 41.69 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.207 -0.933 . . . . 0.0 109.439 179.803 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.553 ' CD ' ' N ' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -135.66 67.02 1.49 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.262 -0.899 . . . . 0.0 109.472 179.708 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.3 m -157.15 116.87 3.43 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.304 -0.873 . . . . 0.0 109.403 179.551 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.584 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -53.78 -46.84 98.25 Favored Pre-proline 0 N--CA 1.489 1.52 0 O-C-N 121.256 -0.902 . . . . 0.0 109.542 -178.933 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.584 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 52.2 Cg_exo -54.35 -39.13 88.51 Favored 'Trans proline' 0 C--N 1.305 -1.717 0 C-N-CA 122.805 2.336 . . . . 0.0 112.202 179.433 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -61.54 -36.3 80.19 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.297 -0.877 . . . . 0.0 109.448 179.369 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.592 HD11 ' CE2' ' A' ' 45' ' ' PHE . 11.2 mp -66.46 -42.58 87.35 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.255 -0.903 . . . . 0.0 109.437 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -66.89 -50.41 62.54 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.174 -0.954 . . . . 0.0 109.471 -179.563 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.463 HH12 ' HB3' ' A' ' 49' ' ' PRO . 96.1 mtm-85 -60.18 -44.88 94.71 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.209 -0.932 . . . . 0.0 109.542 -179.378 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 67.8 t80 -65.81 -55.21 18.31 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.201 -0.937 . . . . 0.0 109.466 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 96.5 mt -61.45 -42.01 98.1 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.21 -0.931 . . . . 0.0 109.504 -179.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 93.94 -146.53 18.18 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 109.561 -1.416 . . . . 0.0 109.561 179.689 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -98.16 27.38 19.54 Favored Glycine 0 N--CA 1.492 2.381 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 179.761 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 13.0 m -89.42 -25.8 21.33 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.261 -1.141 . . . . 0.0 109.485 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 97.5 mtp -143.45 134.29 25.33 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.273 -0.892 . . . . 0.0 109.412 179.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -97.94 116.39 30.05 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.284 -0.885 . . . . 0.0 109.461 179.274 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.433 HD23 ' HA ' ' A' ' 61' ' ' LEU . 97.1 mt -95.82 2.75 53.95 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.119 -0.988 . . . . 0.0 109.469 -179.556 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 69.0 m -50.76 -39.01 51.2 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.255 -0.903 . . . . 0.0 109.506 179.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 31.4 p -94.6 39.67 1.09 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.254 -0.904 . . . . 0.0 109.52 179.229 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 85.0 t80 -125.75 125.67 43.35 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.257 -0.902 . . . . 0.0 109.437 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.603 ' O ' ' N ' ' A' ' 69' ' ' GLY . 89.3 m-20 -76.71 107.66 9.18 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.168 -0.958 . . . . 0.0 109.524 -179.609 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.672 ' CE1' ' CE1' ' A' ' 37' ' ' TYR . 54.5 t80 -74.78 -48.88 23.05 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.174 -0.953 . . . . 0.0 109.51 -179.821 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 18.3 mmm180 -54.72 -42.26 71.32 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.276 -0.89 . . . . 0.0 109.564 179.666 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 6.7 p -98.09 -14.35 20.51 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.169 -0.957 . . . . 0.0 109.462 -179.748 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.603 ' N ' ' O ' ' A' ' 65' ' ' ASP . . . 64.77 31.68 81.7 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 179.728 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.417 ' H ' ' HB2' ' A' ' 65' ' ' ASP . 72.0 mmtt -112.57 150.66 31.03 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.227 -1.16 . . . . 0.0 109.436 -179.803 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 11.9 tpp -93.86 123.97 37.56 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.197 -0.939 . . . . 0.0 109.484 179.848 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.484 HD13 ' C ' ' A' ' 72' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.573 0 O-C-N 121.135 -0.978 . . . . 0.0 109.458 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.529 4.853 0 N-CA-C 119.361 2.504 . . . . 0.0 119.361 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.6 p -72.26 163.78 27.38 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.233 -1.157 . . . . 0.0 109.45 179.584 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.612 ' O ' ' C ' ' A' ' 4' ' ' GLU . 14.8 ttt -77.99 91.27 4.22 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.217 -0.927 . . . . 0.0 109.374 -179.779 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.612 ' C ' ' O ' ' A' ' 3' ' ' MET . 5.3 pt-20 29.01 86.6 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.153 -0.967 . . . . 0.0 109.486 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 31.0 ptt180 -48.14 127.36 12.39 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.168 -0.957 . . . . 0.0 109.464 -179.543 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.426 ' HB2' ' H ' ' A' ' 21' ' ' GLU . 2.5 mmtp -63.06 147.8 49.68 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.352 -0.843 . . . . 0.0 109.501 -179.291 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 73.6 ttp85 -149.97 138.93 21.02 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.234 -0.916 . . . . 0.0 109.472 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.57 ' N ' ' CD1' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -167.33 142.2 3.9 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.22 -0.925 . . . . 0.0 109.463 -179.828 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -103.64 142.45 34.3 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.241 -0.912 . . . . 0.0 109.458 178.517 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.818 ' SG ' HD13 ' A' ' 13' ' ' LEU . 0.8 OUTLIER -115.19 129.15 25.32 Favored Pre-proline 0 N--CA 1.49 1.568 0 O-C-N 121.311 -0.868 . . . . 0.0 109.461 -179.657 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -51.16 -24.26 14.59 Favored 'Trans proline' 0 C--N 1.305 -1.715 0 C-N-CA 122.901 2.401 . . . . 0.0 112.233 178.499 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.466 ' O ' ' SD ' ' A' ' 59' ' ' MET . . . -71.08 -16.44 62.58 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.196 -0.94 . . . . 0.0 109.496 -179.602 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.818 HD13 ' SG ' ' A' ' 10' ' ' CYS . 5.5 mp -102.01 148.95 36.08 Favored Pre-proline 0 N--CA 1.49 1.565 0 O-C-N 121.192 -0.943 . . . . 0.0 109.402 -179.894 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.465 ' HG2' ' CD1' ' A' ' 17' ' ' TRP . 37.3 Cg_endo -67.5 149.0 79.9 Favored 'Trans proline' 0 C--N 1.305 -1.726 0 C-N-CA 122.904 2.403 . . . . 0.0 112.17 179.876 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.618 ' NE2' ' O ' ' A' ' 15' ' ' GLN . 1.5 pm0 -54.44 125.98 21.65 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.294 -0.878 . . . . 0.0 109.506 -179.131 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 122.38 -29.12 5.58 Favored Glycine 0 N--CA 1.491 2.337 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 179.351 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . 0.603 ' CZ2' ' OG ' ' A' ' 39' ' ' SER . 17.0 m95 -89.23 155.42 19.41 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.213 -1.169 . . . . 0.0 109.452 179.363 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -149.63 164.54 34.89 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.142 -0.974 . . . . 0.0 109.429 -178.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.602 ' NH1' ' O ' ' A' ' 69' ' ' GLY . 13.0 mtm105 -132.69 131.99 41.89 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.245 -0.909 . . . . 0.0 109.476 178.772 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -136.48 141.54 43.49 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.175 -0.953 . . . . 0.0 109.562 -178.771 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.537 ' OE2' ' CZ ' ' A' ' 33' ' ' ARG . 80.4 tt0 -102.43 147.01 27.25 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.315 -0.866 . . . . 0.0 109.358 179.022 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.5 t -149.31 127.59 5.9 Favored Pre-proline 0 N--CA 1.49 1.535 0 O-C-N 121.184 -0.948 . . . . 0.0 109.65 -178.603 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -77.33 140.07 19.16 Favored 'Trans proline' 0 C--N 1.306 -1.707 0 C-N-CA 122.851 2.367 . . . . 0.0 112.167 178.629 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.573 ' NE ' ' OD1' ' A' ' 34' ' ' ASP . 99.2 mtt180 -68.84 153.56 43.57 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.186 -0.947 . . . . 0.0 109.534 179.526 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 89.6 mtm180 -129.45 -28.09 2.34 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.243 -0.911 . . . . 0.0 109.525 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 44.1 t -144.1 112.45 6.44 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.314 -0.866 . . . . 0.0 109.545 -179.731 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 171.83 170.23 35.56 Favored Glycine 0 N--CA 1.491 2.3 0 N-CA-C 109.619 -1.392 . . . . 0.0 109.619 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.493 ' N ' HD12 ' A' ' 28' ' ' LEU . 11.0 mp -62.58 -41.53 99.01 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.199 -1.177 . . . . 0.0 109.502 179.871 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.484 ' O ' ' C ' ' A' ' 30' ' ' ALA . 6.1 m -93.37 14.13 19.38 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.343 -0.848 . . . . 0.0 109.377 -179.784 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.484 ' C ' ' O ' ' A' ' 29' ' ' SER . . . -40.11 133.75 1.67 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.254 -0.904 . . . . 0.0 109.465 179.734 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 122.71 -34.85 3.62 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.499 -1.44 . . . . 0.0 109.499 -179.735 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -80.5 174.15 11.9 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.221 -1.164 . . . . 0.0 109.554 179.586 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.537 ' CZ ' ' OE2' ' A' ' 21' ' ' GLU . 83.7 mtp180 -120.25 136.72 54.56 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.256 -0.903 . . . . 0.0 109.415 -179.721 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.573 ' OD1' ' NE ' ' A' ' 24' ' ' ARG . 4.6 m-20 -122.74 143.5 49.78 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.239 -0.913 . . . . 0.0 109.419 -179.709 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 65.5 t -105.9 136.1 41.55 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 O-C-N 121.244 -0.91 . . . . 0.0 109.442 179.816 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -122.27 147.08 46.66 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.358 -0.838 . . . . 0.0 109.51 179.857 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.453 ' CB ' ' CE2' ' A' ' 45' ' ' PHE . 8.5 m-85 -112.71 139.32 48.42 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.251 -0.906 . . . . 0.0 109.455 -179.878 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 74.7 m-85 -114.33 128.44 56.35 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.221 -0.924 . . . . 0.0 109.575 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.603 ' OG ' ' CZ2' ' A' ' 17' ' ' TRP . 0.1 OUTLIER -97.61 177.28 1.69 Allowed Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.279 -0.888 . . . . 0.0 109.447 179.251 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.444 ' CD ' ' CB ' ' A' ' 39' ' ' SER . 52.8 Cg_exo -53.76 -30.39 56.57 Favored 'Trans proline' 0 C--N 1.306 -1.677 0 C-N-CA 122.904 2.402 . . . . 0.0 112.24 179.402 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 96.4 p -87.52 4.97 41.42 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.317 -0.864 . . . . 0.0 109.461 179.56 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 74.9 12.86 82.94 Favored Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 179.755 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 5.4 ttmt -73.32 131.27 41.72 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.24 -1.153 . . . . 0.0 109.452 -179.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 16.9 pttp -94.7 130.05 41.36 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.247 -0.908 . . . . 0.0 109.447 179.195 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.668 ' N ' ' CD1' ' A' ' 45' ' ' PHE . 0.7 OUTLIER -139.53 146.3 39.74 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.271 -0.893 . . . . 0.0 109.399 -179.918 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 46.0 ptt85 -139.88 53.07 1.68 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.367 -0.833 . . . . 0.0 109.506 -179.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.4 p -150.93 134.99 16.73 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.281 -0.887 . . . . 0.0 109.464 179.573 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.607 ' N ' ' CD ' ' A' ' 49' ' ' PRO . 0.9 OUTLIER -58.42 -46.13 99.64 Favored Pre-proline 0 N--CA 1.49 1.563 0 O-C-N 121.216 -0.927 . . . . 0.0 109.461 179.887 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.607 ' CD ' ' N ' ' A' ' 48' ' ' LYS . 52.2 Cg_exo -53.16 -43.23 58.92 Favored 'Trans proline' 0 C--N 1.305 -1.717 0 C-N-CA 122.836 2.357 . . . . 0.0 112.189 -179.655 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -68.19 -33.94 75.36 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.248 -0.907 . . . . 0.0 109.522 179.096 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.635 ' O ' HD13 ' A' ' 51' ' ' LEU . 0.3 OUTLIER -59.37 -49.68 76.88 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.246 -0.909 . . . . 0.0 109.488 179.65 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -71.77 -37.6 70.45 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.183 -0.948 . . . . 0.0 109.55 -179.566 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 42.3 ttm180 -56.22 -51.08 69.4 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.247 -0.908 . . . . 0.0 109.558 -179.336 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.441 ' C ' ' H ' ' A' ' 56' ' ' GLY . 18.4 t80 -68.51 -50.03 55.17 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.368 -0.833 . . . . 0.0 109.503 -179.708 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.436 ' O ' ' OG ' ' A' ' 58' ' ' SER . 4.2 mm? -64.23 1.2 0.78 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.144 -0.972 . . . . 0.0 109.444 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.548 ' O ' ' C ' ' A' ' 57' ' ' GLY . . . 51.91 64.0 4.31 Favored Glycine 0 N--CA 1.492 2.384 0 N-CA-C 109.46 -1.456 . . . . 0.0 109.46 179.794 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . 0.548 ' C ' ' O ' ' A' ' 56' ' ' GLY . . . 33.82 36.0 0.05 OUTLIER Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.556 -1.417 . . . . 0.0 109.556 -179.515 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.53 ' N ' ' O ' ' A' ' 56' ' ' GLY . 74.2 m -85.24 -0.58 55.1 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.21 -1.171 . . . . 0.0 109.486 179.746 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.466 ' SD ' ' O ' ' A' ' 12' ' ' ALA . 40.6 ttp -157.34 149.69 22.86 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.351 -0.843 . . . . 0.0 109.497 -179.869 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 91.1 m-20 -86.34 106.35 17.33 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.292 -0.88 . . . . 0.0 109.405 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.6 ' N ' HD22 ' A' ' 61' ' ' LEU . 3.7 mm? -89.61 -4.89 57.62 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.222 -0.924 . . . . 0.0 109.462 -179.933 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 37.9 m -58.49 -33.89 70.3 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.297 -0.877 . . . . 0.0 109.532 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 17.9 p -96.45 9.22 42.01 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.178 -0.951 . . . . 0.0 109.48 -179.82 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 89.7 t80 -90.24 135.12 33.87 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.225 -0.922 . . . . 0.0 109.419 179.807 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.515 ' O ' ' N ' ' A' ' 69' ' ' GLY . 9.8 m-20 -85.67 111.29 19.95 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.248 -0.908 . . . . 0.0 109.582 179.818 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 77.4 t80 -75.16 -47.64 27.45 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.211 -0.931 . . . . 0.0 109.392 -179.286 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.45 ' HA ' ' HE ' ' A' ' 67' ' ' ARG . 0.3 OUTLIER -56.4 -43.84 79.7 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.251 -0.906 . . . . 0.0 109.474 -179.351 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 30.0 p -94.51 -15.38 24.21 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.165 -0.959 . . . . 0.0 109.515 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.602 ' O ' ' NH1' ' A' ' 19' ' ' ARG . . . 63.69 35.68 92.35 Favored Glycine 0 N--CA 1.49 2.239 0 N-CA-C 109.568 -1.413 . . . . 0.0 109.568 179.797 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 54.8 mtpt -125.61 151.35 46.6 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.329 -1.101 . . . . 0.0 109.529 -179.543 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 10.8 tpp -93.54 121.78 35.3 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.257 -0.902 . . . . 0.0 109.405 179.812 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 56.4 tp . . . . . 0 N--CA 1.49 1.559 0 O-C-N 121.179 -0.951 . . . . 0.0 109.416 179.876 . . . . . . . . 0 0 . 1 stop_ save_