data_2ma6_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 2ma6 _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 ' 10' ' ' LEU . . . . . 0.699 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 93.8 mt . . . . . 0 CA--C 1.539 0.532 0 CA-C-O 120.355 0.121 . . . . 0.0 110.903 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.51 ' SG ' ' HB2' ' A' ' 30' ' ' SER . 42.0 t -49.71 111.62 2.16 Favored Pre-proline 0 CA--C 1.547 0.862 0 C-N-CA 124.753 1.221 . . . . 0.0 110.211 179.589 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -62.44 -21.41 72.72 Favored 'Trans proline' 0 C--N 1.378 2.089 0 C-N-CA 123.22 2.614 . . . . 0.0 113.661 -171.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 64.9 mt -68.41 -27.54 37.07 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.153 0 C-N-CA 124.064 0.946 . . . . 0.0 111.411 176.573 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 64.6 m -125.75 -32.85 2.8 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 -164.215 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 68.03 -47.02 0.52 Allowed 'General case' 0 N--CA 1.495 1.799 0 C-N-CA 125.807 1.643 . . . . 0.0 114.068 -173.006 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -66.52 -37.76 85.73 Favored 'General case' 0 CA--C 1.55 0.946 0 N-CA-C 113.677 0.991 . . . . 0.0 113.677 -168.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 20.8 m-70 -118.77 150.88 49.25 Favored Pre-proline 0 N--CA 1.491 1.6 0 C-N-CA 123.58 0.752 . . . . 0.0 109.85 -176.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.699 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 43.9 Cg_endo -84.26 -173.35 1.51 Allowed 'Trans proline' 0 C--N 1.379 2.134 0 C-N-CA 123.042 2.495 . . . . 0.0 113.42 -178.116 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 82.8 mt -80.31 142.54 13.76 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.794 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.349 176.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.483 ' HB3' ' HG3' ' A' ' 32' ' ' LYS . 23.1 t -150.17 -4.01 0.36 Allowed 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 123.236 0.614 . . . . 0.0 111.692 177.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -137.64 132.4 32.93 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.017 0.527 . . . . 0.0 110.725 -175.104 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 12.9 p -106.05 145.85 13.47 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 C-N-CA 124.621 1.168 . . . . 0.0 109.6 174.029 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 19.7 m-85 -112.59 88.27 2.78 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.694 0.798 . . . . 0.0 109.496 -175.304 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 51.0 mt-30 -75.82 155.83 84.81 Favored Pre-proline 0 C--O 1.243 0.737 0 C-N-CA 124.078 0.951 . . . . 0.0 111.824 -176.531 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -82.32 2.21 50.62 Favored 'Cis proline' 0 N--CA 1.508 2.333 0 N-CA-C 114.585 0.956 . . . . 0.0 114.585 -2.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 41.5 t -64.44 -49.65 70.62 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.303 0.641 . . . . 0.0 112.308 -177.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 101.65 -3.1 53.14 Favored Glycine 0 CA--C 1.529 0.955 0 CA-C-O 118.47 -1.183 . . . . 0.0 114.691 178.196 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.596 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 4.4 m170 -62.74 145.04 55.75 Favored 'General case' 0 N--CA 1.492 1.67 0 CA-C-N 118.493 1.146 . . . . 0.0 110.01 175.569 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 50.8 mttp -133.34 147.91 51.85 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 122.738 0.415 . . . . 0.0 111.254 -169.254 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.51 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 88.1 p -161.19 -169.7 2.42 Favored 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 124.105 0.962 . . . . 0.0 108.971 174.045 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 17.7 p -74.42 151.96 39.56 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 122.561 0.345 . . . . 0.0 110.372 177.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.483 ' HG3' ' HB3' ' A' ' 20' ' ' SER . 28.0 mtpp -58.69 -37.77 76.8 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.141 0.576 . . . . 0.0 111.439 179.057 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -58.3 -28.64 65.2 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.51 0.724 . . . . 0.0 112.68 178.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.2 m -59.54 -62.15 2.09 Favored 'General case' 0 N--CA 1.483 1.18 0 O-C-N 123.747 0.655 . . . . 0.0 110.89 177.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.623 HG12 HG21 ' A' ' 55' ' ' VAL . 7.3 tp -66.76 -41.06 87.38 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 O-C-N 123.8 0.688 . . . . 0.0 111.447 -172.371 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -58.53 -43.65 89.3 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 122.808 0.443 . . . . 0.0 110.816 179.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -71.77 -34.84 69.8 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.39 0.676 . . . . 0.0 109.893 176.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 74.9 t60 -70.98 -28.57 64.54 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.288 1.035 . . . . 0.0 111.097 -176.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.423 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 94.7 mt -70.61 -11.25 60.82 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.426 0.69 . . . . 0.0 111.632 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 30.8 mmt -82.15 -14.27 55.94 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.941 0.896 . . . . 0.0 110.931 172.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 -116.09 -74.19 0.62 Allowed 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.699 1.2 . . . . 0.0 109.783 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 79.0 m-20 -125.28 -168.09 1.78 Allowed 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 124.528 1.131 . . . . 0.0 110.9 -176.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -134.66 24.59 3.7 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 124.312 1.045 . . . . 0.0 109.512 171.291 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -87.57 165.1 15.71 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-O 121.326 0.584 . . . . 0.0 111.85 -175.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.596 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 43.5 t -94.19 36.15 1.15 Allowed 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.813 1.245 . . . . 0.0 112.086 -169.557 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 54.16 -82.39 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 125.429 1.492 . . . . 0.0 113.197 169.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 41.6 m-85 -70.71 -11.99 61.28 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.119 1.368 . . . . 0.0 113.071 -169.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 15.3 p -143.14 -7.13 0.81 Allowed 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 122.87 0.468 . . . . 0.0 111.638 178.395 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 52.1 tttm 63.03 22.79 13.65 Favored 'General case' 0 CA--C 1.569 1.676 0 C-N-CA 124.496 1.118 . . . . 0.0 113.124 176.292 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 56.0 m -73.13 151.84 41.42 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.216 0.607 . . . . 0.0 110.625 174.173 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 56.6 m -63.43 120.5 11.77 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 122.605 0.362 . . . . 0.0 110.373 174.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.436 HG21 HG23 ' A' ' 55' ' ' VAL . 49.5 mt -79.9 111.38 16.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 172.681 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 87.2 t -75.57 -46.04 37.89 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 O-C-N 123.452 0.47 . . . . 0.0 109.75 176.587 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.5 m -141.91 134.4 28.16 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 122.828 0.451 . . . . 0.0 110.677 -179.268 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.623 HG21 HG12 ' A' ' 35' ' ' ILE . 41.6 t -102.3 104.12 16.01 Favored 'Isoleucine or valine' 0 C--O 1.244 0.781 0 C-N-CA 123.776 0.831 . . . . 0.0 108.888 172.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 52.8 mm-40 -105.0 156.78 17.72 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 109.843 -0.429 . . . . 0.0 109.843 179.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -78.79 108.11 11.99 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.319 175.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 53.2 t90 . . . . . 0 CA--C 1.542 0.648 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 175.346 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.674 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 58.9 mt . . . . . 0 N--CA 1.47 0.535 0 CA-C-O 121.047 0.451 . . . . 0.0 111.856 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 42.6 t -61.33 118.98 42.12 Favored Pre-proline 0 CA--C 1.549 0.936 0 CA-C-N 115.041 -0.981 . . . . 0.0 109.705 177.19 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -71.07 -3.58 13.14 Favored 'Trans proline' 0 C--N 1.379 2.182 0 C-N-CA 123.082 2.521 . . . . 0.0 113.498 -175.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 61.1 mt -91.95 -22.69 5.95 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.311 0 C-N-CA 124.367 1.067 . . . . 0.0 110.529 177.376 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 71.2 m -124.75 -51.38 1.71 Allowed 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.257 0.623 . . . . 0.0 112.073 -167.033 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 90.8 m-85 71.69 -8.83 1.02 Allowed 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 125.669 1.588 . . . . 0.0 113.587 179.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -100.4 -14.22 18.42 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 118.962 0.801 . . . . 0.0 111.513 179.022 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 85.2 m-70 -138.68 149.45 62.37 Favored Pre-proline 0 N--CA 1.485 1.296 0 C-N-CA 123.403 0.681 . . . . 0.0 109.74 177.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.674 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 64.2 Cg_endo -68.95 174.33 8.95 Favored 'Trans proline' 0 C--N 1.383 2.392 0 C-N-CA 123.422 2.748 . . . . 0.0 114.572 -177.429 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 73.2 mt -72.7 127.78 34.98 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 N-CA-C 107.718 -1.215 . . . . 0.0 107.718 167.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 51.5 p -142.65 15.27 1.97 Allowed 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.191 0.596 . . . . 0.0 111.531 -174.358 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -154.82 149.34 26.32 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.544 0.738 . . . . 0.0 110.242 -176.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.7 p -140.69 126.53 20.23 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 175.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -87.16 104.73 16.64 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.905 0.882 . . . . 0.0 109.429 -172.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -100.63 142.91 25.53 Favored Pre-proline 0 CA--C 1.556 1.186 0 C-N-CA 123.972 0.909 . . . . 0.0 109.587 -175.009 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.46 ' HD3' ' HB ' ' A' ' 53' ' ' VAL . 85.8 Cg_endo -96.31 89.88 0.12 OUTLIER 'Cis proline' 0 C--N 1.382 2.29 0 CA-C-N 120.073 1.062 . . . . 0.0 112.411 -1.764 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 47.8 t -142.95 -39.84 0.33 Allowed 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 116.095 -0.502 . . . . 0.0 112.056 173.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 100.88 -16.28 57.55 Favored Glycine 0 C--N 1.349 1.269 0 CA-C-O 118.96 -0.911 . . . . 0.0 114.339 175.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.574 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 11.6 m170 -59.77 134.18 56.79 Favored 'General case' 0 N--CA 1.489 1.507 0 CA-C-N 117.789 0.795 . . . . 0.0 110.266 174.865 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -116.57 160.23 20.96 Favored 'General case' 0 C--O 1.238 0.471 0 C-N-CA 123.814 0.846 . . . . 0.0 111.039 -173.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 45.2 t -174.4 -176.19 1.06 Allowed 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.292 1.437 . . . . 0.0 108.57 -177.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 16.1 p -89.75 151.4 21.85 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 173.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.1 -25.16 67.97 Favored 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -178.269 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.2 -41.55 88.82 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.489 0.716 . . . . 0.0 111.499 174.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.7 m -56.87 -56.6 19.5 Favored 'General case' 0 N--CA 1.477 0.92 0 O-C-N 124.255 0.972 . . . . 0.0 111.109 178.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.52 HG12 HG23 ' A' ' 55' ' ' VAL . 8.0 tp -69.41 -38.97 78.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 O-C-N 123.578 0.549 . . . . 0.0 110.8 -171.624 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 86.6 m-20 -62.93 -37.64 87.83 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 122.728 0.411 . . . . 0.0 110.992 176.563 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 63.8 tt0 -70.81 -34.17 71.45 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.187 0.595 . . . . 0.0 110.737 175.422 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 33.0 t60 -70.21 -34.71 73.24 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.743 0.817 . . . . 0.0 109.936 179.123 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.428 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 98.1 mt -72.83 -7.53 51.22 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.956 0.902 . . . . 0.0 111.798 -179.3 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 94.1 mmm -79.26 -16.96 55.63 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.47 0.708 . . . . 0.0 110.809 170.299 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 64.9 m-20 -116.9 -73.58 0.64 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.814 0.846 . . . . 0.0 109.644 -179.031 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -125.39 -167.26 1.66 Allowed 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 124.718 1.207 . . . . 0.0 110.328 -175.712 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 89.0 tttt -142.13 81.46 1.75 Allowed 'General case' 0 N--CA 1.476 0.866 0 CA-C-O 121.393 0.616 . . . . 0.0 109.808 178.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.465 ' HB3' ' HA ' ' A' ' 49' ' ' LYS . 15.2 m-20 -136.1 166.26 23.8 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-O 121.946 0.879 . . . . 0.0 110.89 -173.735 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.574 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 41.9 t -92.9 29.68 1.76 Allowed 'General case' 0 N--CA 1.48 1.034 0 CA-C-N 113.818 -1.537 . . . . 0.0 110.564 178.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 63.4 -85.69 0.02 OUTLIER 'General case' 0 C--N 1.358 0.953 0 C-N-CA 125.197 1.399 . . . . 0.0 112.698 172.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 43.8 m-85 -64.2 -51.82 61.88 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.579 1.152 . . . . 0.0 111.014 -166.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 20.2 p -93.19 -11.8 31.85 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.561 -178.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.526 ' HZ2' ' HB2' ' A' ' 49' ' ' LYS . 0.1 OUTLIER 61.21 27.51 17.24 Favored 'General case' 0 N--CA 1.495 1.797 0 C-N-CA 124.987 1.315 . . . . 0.0 113.26 -176.452 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 85.5 m -65.42 118.91 10.08 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.039 0.535 . . . . 0.0 109.625 169.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 85.3 m -56.1 129.29 39.36 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.313 0.645 . . . . 0.0 110.528 179.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.425 HG13 HD13 ' A' ' 35' ' ' ILE . 40.2 mm -63.7 126.09 21.61 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.775 0 C-N-CA 122.971 0.508 . . . . 0.0 111.48 -174.642 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.46 ' HB ' ' HD3' ' A' ' 25' ' ' PRO . 60.9 t -97.67 -42.9 11.9 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 169.434 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.1 t -153.9 151.95 30.05 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.927 0.891 . . . . 0.0 110.255 177.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.52 HG23 HG12 ' A' ' 35' ' ' ILE . 43.1 t -124.5 122.44 63.9 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 169.83 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -93.04 150.98 20.15 Favored 'General case' 0 C--O 1.242 0.671 0 C-N-CA 122.881 0.472 . . . . 0.0 110.679 179.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -76.02 95.85 3.68 Favored 'General case' 0 C--O 1.242 0.704 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 172.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 61.4 t90 . . . . . 0 CA--C 1.54 0.584 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 -177.823 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.579 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 96.9 mt . . . . . 0 C--O 1.235 0.319 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.535 ' SG ' ' HB2' ' A' ' 30' ' ' SER . 47.5 t -62.58 113.22 8.29 Favored Pre-proline 0 CA--C 1.538 0.486 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 169.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -58.73 -20.29 50.43 Favored 'Trans proline' 0 C--N 1.373 1.821 0 C-N-CA 122.921 2.414 . . . . 0.0 113.894 -172.07 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.8 mp -80.93 -49.7 17.89 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.159 0 C-N-CA 123.686 0.795 . . . . 0.0 110.393 176.364 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 95.8 m -79.84 -47.57 14.93 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.23 0.612 . . . . 0.0 112.469 -170.179 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 74.66 -37.96 0.37 Allowed 'General case' 0 N--CA 1.497 1.878 0 C-N-CA 126.076 1.751 . . . . 0.0 113.14 -174.592 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -91.2 0.47 57.52 Favored 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 112.914 0.709 . . . . 0.0 112.914 -175.357 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 92.1 m-70 -146.63 151.33 42.58 Favored Pre-proline 0 N--CA 1.49 1.539 0 C-N-CA 123.833 0.853 . . . . 0.0 108.812 177.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.579 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 78.7 Cg_endo -77.49 -169.8 0.82 Allowed 'Trans proline' 0 C--N 1.378 2.087 0 C-N-CA 123.528 2.819 . . . . 0.0 114.275 -175.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 84.8 mt -85.94 155.12 3.42 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.346 0 C-N-CA 124.685 1.194 . . . . 0.0 110.732 177.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 34.8 t -141.56 -10.96 0.92 Allowed 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 124.049 0.94 . . . . 0.0 111.511 177.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -149.94 146.73 27.22 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.094 0.558 . . . . 0.0 111.605 -170.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.6 p -111.66 141.03 28.34 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 124.293 1.037 . . . . 0.0 110.22 175.011 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 17.7 m-85 -97.72 96.16 8.06 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.647 0.779 . . . . 0.0 108.957 176.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 36.3 mt-30 -90.26 148.83 40.06 Favored Pre-proline 0 CA--C 1.543 0.698 0 C-N-CA 123.344 0.658 . . . . 0.0 110.983 -179.273 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -88.18 13.92 50.0 Favored 'Cis proline' 0 C--N 1.38 2.197 0 N-CA-C 114.606 0.964 . . . . 0.0 114.606 4.473 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 52.2 t -67.08 -70.41 0.25 Allowed 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -173.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 130.4 -24.2 4.45 Favored Glycine 0 C--N 1.347 1.172 0 CA-C-O 119.487 -0.618 . . . . 0.0 113.052 -177.096 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.559 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 25.6 m170 -61.29 145.77 50.26 Favored 'General case' 0 N--CA 1.486 1.363 0 CA-C-N 117.427 0.613 . . . . 0.0 110.168 171.546 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 60.4 mttp -136.82 161.32 36.32 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.404 0.682 . . . . 0.0 111.001 -171.127 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.535 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 51.3 p -165.41 -174.47 3.19 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.201 1.0 . . . . 0.0 108.99 173.153 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 17.4 p -79.17 156.35 28.25 Favored 'General case' 0 C--O 1.246 0.898 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 173.133 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -64.41 -26.61 68.53 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.302 0.641 . . . . 0.0 112.302 -177.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.37 -35.35 77.21 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.063 0.545 . . . . 0.0 111.937 176.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 17.6 m -69.28 -43.73 73.3 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.306 0.642 . . . . 0.0 111.564 179.031 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.524 HG12 HG23 ' A' ' 55' ' ' VAL . 9.8 tp -75.96 -31.73 22.43 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 CA-C-O 119.662 -0.209 . . . . 0.0 110.928 -177.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 58.6 t30 -61.25 -44.81 96.63 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 174.106 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 42.6 tt0 -58.46 -44.0 89.11 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 124.76 1.224 . . . . 0.0 110.907 173.004 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 49.4 t60 -71.69 -35.22 70.19 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.492 -172.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 90.6 mt -69.61 -11.91 61.21 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.397 0.679 . . . . 0.0 112.126 -178.267 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 19.3 mmt -78.56 -14.89 59.11 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 123.87 0.868 . . . . 0.0 110.585 173.016 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 21.1 m-80 -115.98 -75.84 0.58 Allowed 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.505 1.122 . . . . 0.0 109.416 -178.213 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 49.4 m-80 -132.22 -170.93 2.52 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 124.319 1.047 . . . . 0.0 110.01 -176.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -132.68 29.41 4.18 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 123.379 0.672 . . . . 0.0 110.025 177.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.421 ' HA ' ' HA ' ' A' ' 51' ' ' THR . 23.8 m-20 -89.76 161.11 16.21 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.748 0.819 . . . . 0.0 110.992 178.477 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.559 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 40.8 t -91.7 60.43 3.97 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.195 0.598 . . . . 0.0 111.762 -175.58 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 36.0 m-85 47.71 -90.84 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 126.183 1.793 . . . . 0.0 113.922 168.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 -73.51 -56.84 4.51 Favored 'General case' 0 C--N 1.354 0.804 0 C-N-CA 123.775 0.83 . . . . 0.0 110.879 -169.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 13.1 p -77.83 -20.39 53.24 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.857 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 1.2 tmtp? 69.29 1.46 3.27 Favored 'General case' 0 CA--C 1.564 1.514 0 C-N-CA 125.133 1.373 . . . . 0.0 113.433 176.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 29.1 m -56.79 120.98 8.78 Favored 'General case' 0 CA--C 1.551 1.006 0 O-C-N 121.593 -0.692 . . . . 0.0 110.041 175.438 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.421 ' HA ' ' HA ' ' A' ' 44' ' ' ASP . 21.4 m -59.98 129.25 40.87 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.16 0.584 . . . . 0.0 111.053 -174.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.487 HG21 HG22 ' A' ' 55' ' ' VAL . 17.1 mt -81.62 127.75 39.31 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 C-N-CA 124.052 0.941 . . . . 0.0 109.552 -175.129 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 78.0 t -74.97 -50.61 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 N-CA-C 109.273 -0.639 . . . . 0.0 109.273 173.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 33.0 t -147.4 134.67 20.6 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.214 -179.3 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.524 HG23 HG12 ' A' ' 35' ' ' ILE . 44.2 t -98.87 103.03 14.19 Favored 'Isoleucine or valine' 0 C--O 1.239 0.526 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 175.073 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -91.91 169.17 10.89 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 177.091 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -82.49 150.28 27.1 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 170.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 81.6 t90 . . . . . 0 C--O 1.243 0.756 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 173.653 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.658 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 96.6 mt . . . . . 0 C--O 1.237 0.399 0 CA-C-O 120.52 0.2 . . . . 0.0 110.471 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 35.4 t -61.74 116.34 20.39 Favored Pre-proline 0 CA--C 1.545 0.762 0 O-C-N 124.032 0.832 . . . . 0.0 108.952 172.436 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -64.95 -7.66 15.82 Favored 'Trans proline' 0 C--N 1.373 1.849 0 C-N-CA 123.029 2.486 . . . . 0.0 113.476 -172.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.3 mp -90.93 -54.09 7.97 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.151 0 C-N-CA 124.096 0.958 . . . . 0.0 109.436 172.05 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 70.7 m -83.73 -58.63 2.72 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 122.958 0.503 . . . . 0.0 112.333 -171.006 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.431 ' HA ' ' HB3' ' A' ' 10' ' ' LEU . 92.1 m-85 75.3 -36.23 0.3 Allowed 'General case' 0 N--CA 1.494 1.739 0 C-N-CA 126.243 1.817 . . . . 0.0 111.996 -170.734 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.92 -27.84 67.09 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 124.322 1.049 . . . . 0.0 112.452 178.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 42.3 m80 -135.48 154.8 78.65 Favored Pre-proline 0 CA--C 1.557 1.214 0 C-N-CA 124.345 1.058 . . . . 0.0 109.977 176.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.658 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 84.7 Cg_endo -73.98 -165.08 0.24 Allowed 'Trans proline' 0 C--N 1.378 2.125 0 C-N-CA 123.361 2.707 . . . . 0.0 114.678 -175.631 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 83.4 mt -84.09 150.24 4.17 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.0 0 C-N-CA 124.139 0.976 . . . . 0.0 110.416 175.346 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 6.9 m -138.99 -26.54 0.84 Allowed 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.752 0.821 . . . . 0.0 111.317 -178.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -139.7 140.08 36.74 Favored 'General case' 0 C--O 1.241 0.644 0 C-N-CA 123.608 0.763 . . . . 0.0 110.386 -174.338 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.6 p -102.89 139.93 22.53 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 C-N-CA 123.923 0.889 . . . . 0.0 109.974 175.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 10.4 m-85 -88.25 88.28 7.58 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 176.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -85.1 139.68 36.78 Favored Pre-proline 0 CA--C 1.553 1.059 0 CA-C-N 115.067 -0.97 . . . . 0.0 110.208 -172.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -95.71 15.16 39.36 Favored 'Cis proline' 0 C--N 1.386 2.519 0 N-CA-C 114.853 1.059 . . . . 0.0 114.853 4.242 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 44.7 t -59.96 -59.74 4.94 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -173.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 123.71 -28.89 5.34 Favored Glycine 0 C--N 1.344 0.998 0 CA-C-O 119.299 -0.723 . . . . 0.0 113.035 -177.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.531 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 13.7 m170 -55.26 139.49 42.29 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 171.454 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 57.9 mttp -129.94 170.62 13.71 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 123.294 0.638 . . . . 0.0 110.642 -177.453 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 47.9 t -175.3 177.19 1.9 Allowed 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.846 1.258 . . . . 0.0 108.624 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 14.3 p -77.38 153.57 33.58 Favored 'General case' 0 C--O 1.25 1.13 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 172.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 48.4 tttm -65.25 -29.54 70.34 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 123.252 0.621 . . . . 0.0 111.334 -173.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -58.54 -43.35 89.23 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.503 0.721 . . . . 0.0 111.49 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 10.9 m -59.27 -51.8 68.42 Favored 'General case' 0 N--CA 1.479 1.021 0 O-C-N 124.029 0.831 . . . . 0.0 111.72 178.457 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.415 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 7.6 tp -73.12 -34.73 45.87 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.779 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.131 -172.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -60.7 -43.03 98.29 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 122.523 0.329 . . . . 0.0 110.246 174.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 7.3 tp60 -65.72 -34.84 79.14 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.835 175.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 57.9 t60 -69.21 -43.15 74.71 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.615 0.766 . . . . 0.0 110.329 -178.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.415 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 78.7 mt -66.96 -14.54 62.94 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 124.533 1.133 . . . . 0.0 112.118 -176.735 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 96.2 mmm -64.97 -16.21 63.11 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.591 0.757 . . . . 0.0 111.422 172.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -133.92 -68.25 0.57 Allowed 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.728 0.811 . . . . 0.0 110.057 174.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 88.1 m-20 -106.13 157.12 17.78 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 124.104 0.961 . . . . 0.0 111.088 -172.093 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.412 ' HD2' ' N ' ' A' ' 43' ' ' LYS . 9.4 mptt -115.68 25.36 10.83 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 123.213 0.605 . . . . 0.0 109.457 179.312 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 50.3 m-20 -91.73 163.15 14.18 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 115.439 -0.8 . . . . 0.0 111.841 -172.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.531 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 43.5 t -93.19 50.23 1.5 Allowed 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.805 0.842 . . . . 0.0 111.301 -176.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 52.44 -84.03 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 125.561 1.544 . . . . 0.0 114.233 170.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 90.9 m-85 -73.8 -62.86 1.35 Allowed 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.126 0.97 . . . . 0.0 110.901 -170.012 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 15.9 p -75.59 -18.97 59.57 Favored 'General case' 0 N--CA 1.48 1.057 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.758 179.291 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt 66.83 13.43 9.4 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 125.073 1.349 . . . . 0.0 113.934 176.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 29.8 m -66.78 125.15 24.96 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 176.014 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 49.1 m -60.27 121.96 13.29 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-O 120.974 0.416 . . . . 0.0 110.214 -179.174 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 38.0 mt -72.61 133.26 32.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 C-N-CA 124.517 1.127 . . . . 0.0 109.987 -174.234 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 90.8 t -77.75 -41.97 28.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 O-C-N 123.647 0.592 . . . . 0.0 109.654 177.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 77.2 p -152.78 134.54 14.63 Favored 'General case' 0 C--O 1.242 0.699 0 C-N-CA 122.76 0.424 . . . . 0.0 110.754 176.356 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 59.8 t -87.7 104.57 14.51 Favored 'Isoleucine or valine' 0 C--O 1.244 0.796 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 170.23 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -103.0 139.46 38.54 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 -172.304 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -70.85 96.15 1.23 Allowed 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.029 0.932 . . . . 0.0 109.502 -178.533 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 88.2 t90 . . . . . 0 C--O 1.24 0.595 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.768 -177.818 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.684 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 96.3 mt . . . . . 0 C--O 1.236 0.39 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 52.1 t -58.61 115.28 11.09 Favored Pre-proline 0 CA--C 1.547 0.841 0 O-C-N 124.234 0.959 . . . . 0.0 109.847 -178.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_endo -58.71 -22.22 60.06 Favored 'Trans proline' 0 N--CA 1.502 2.027 0 C-N-CA 123.141 2.561 . . . . 0.0 113.537 -174.38 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 77.3 mt -80.5 -40.03 19.14 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.338 0 C-N-CA 124.115 0.966 . . . . 0.0 111.14 178.313 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 76.5 m -102.72 -54.48 2.64 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 123.616 0.766 . . . . 0.0 111.226 -170.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 1.7 t80 81.9 -35.87 0.1 Allowed 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 126.616 1.966 . . . . 0.0 111.719 175.36 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.01 -33.63 70.56 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.23 0.612 . . . . 0.0 111.684 179.06 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 41.3 m170 -114.1 150.18 43.18 Favored Pre-proline 0 N--CA 1.483 1.178 0 C-N-CA 123.91 0.884 . . . . 0.0 109.321 179.132 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.684 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 49.4 Cg_endo -79.26 -165.02 0.31 Allowed 'Trans proline' 0 C--N 1.378 2.111 0 C-N-CA 122.924 2.416 . . . . 0.0 113.142 -174.267 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.449 HG22 ' HB3' ' A' ' 29' ' ' LYS . 97.9 mt -86.43 145.09 8.15 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.511 0 C-N-CA 123.946 0.898 . . . . 0.0 109.217 170.889 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.2 m -130.41 -19.99 3.02 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.695 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -137.68 133.77 34.64 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 122.833 0.453 . . . . 0.0 111.91 -168.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.7 p -106.57 140.78 23.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 124.833 1.253 . . . . 0.0 109.418 171.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.522 ' HZ ' ' HG ' ' A' ' 30' ' ' SER . 8.0 m-85 -105.47 93.86 4.9 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.07 0.548 . . . . 0.0 110.0 -171.005 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -66.81 144.04 98.36 Favored Pre-proline 0 CA--C 1.547 0.829 0 C-N-CA 123.368 0.667 . . . . 0.0 111.144 175.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -85.51 0.25 63.69 Favored 'Cis proline' 0 C--N 1.377 2.035 0 N-CA-C 114.216 0.814 . . . . 0.0 114.216 -1.302 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 51.1 t -64.82 -59.74 3.87 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 -168.174 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 116.73 -16.12 13.99 Favored Glycine 0 C--N 1.346 1.129 0 CA-C-O 119.084 -0.842 . . . . 0.0 114.077 -177.311 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.66 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 9.8 m170 -63.62 161.3 15.05 Favored 'General case' 0 N--CA 1.49 1.558 0 CA-C-N 117.98 0.89 . . . . 0.0 110.515 176.15 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.449 ' HB3' HG22 ' A' ' 19' ' ' ILE . 40.3 mtmt -151.35 144.8 24.85 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 115.401 -0.818 . . . . 0.0 112.615 -161.376 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.522 ' HG ' ' HZ ' ' A' ' 23' ' ' PHE . 59.8 p -156.47 -178.59 7.45 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.324 1.05 . . . . 0.0 109.006 170.545 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 16.8 p -72.05 162.06 30.0 Favored 'General case' 0 C--O 1.247 0.96 0 C-N-CA 122.518 0.327 . . . . 0.0 110.449 178.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 32.8 ttmt -55.94 -42.55 76.33 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.316 1.046 . . . . 0.0 110.909 177.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -56.7 -44.89 81.98 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.241 1.016 . . . . 0.0 112.465 -176.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 32.3 m -61.72 -54.94 35.81 Favored 'General case' 0 N--CA 1.481 1.105 0 O-C-N 123.776 0.673 . . . . 0.0 110.868 179.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 9.0 tp -72.54 -28.02 27.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 C-N-CA 122.796 0.438 . . . . 0.0 111.762 -172.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 50.4 t-20 -66.54 -51.78 52.8 Favored 'General case' 0 N--CA 1.486 1.325 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 178.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -69.41 -26.38 64.6 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 114.946 -1.025 . . . . 0.0 111.495 177.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 48.4 t60 -71.33 -41.34 69.96 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.301 0.64 . . . . 0.0 110.216 178.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 92.8 mt -75.08 0.2 16.89 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 123.193 0.597 . . . . 0.0 112.459 -179.006 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 86.3 mtp -80.09 -35.81 36.36 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.478 0.711 . . . . 0.0 109.317 166.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -106.28 -73.5 0.68 Allowed 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.136 0.975 . . . . 0.0 110.981 -173.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 -103.06 -168.6 1.54 Allowed 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 124.345 1.058 . . . . 0.0 110.703 -175.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.407 ' HG3' HG23 ' A' ' 51' ' ' THR . 59.6 pttt -150.55 22.33 0.81 Allowed 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.54 0.736 . . . . 0.0 109.845 176.312 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -97.84 165.39 11.96 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.796 0.838 . . . . 0.0 112.093 -174.062 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.66 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 48.9 t -91.73 39.24 1.0 Allowed 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 124.001 0.921 . . . . 0.0 111.889 -171.636 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 57.05 -84.98 0.02 OUTLIER 'General case' 0 CA--C 1.559 1.314 0 C-N-CA 125.3 1.44 . . . . 0.0 113.156 172.351 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 84.0 m-85 -78.17 -60.41 2.38 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.268 1.027 . . . . 0.0 111.474 -167.275 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 14.2 p -72.13 -21.15 61.51 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-N 117.7 0.227 . . . . 0.0 110.873 178.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 8.3 tmtt? 62.01 39.13 13.61 Favored 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 124.803 1.241 . . . . 0.0 111.019 175.284 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 25.2 m -88.63 137.09 32.64 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 166.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.407 HG23 ' HG3' ' A' ' 43' ' ' LYS . 29.1 m -68.17 120.66 14.72 Favored 'General case' 0 CA--C 1.554 1.1 0 CA-C-N 118.305 0.502 . . . . 0.0 110.406 -178.706 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 55.4 mt -67.44 131.25 33.05 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 C-N-CA 123.845 0.858 . . . . 0.0 110.115 -179.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 93.2 t -87.58 -40.58 13.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 122.855 0.462 . . . . 0.0 110.005 175.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.1 t -152.06 140.57 20.67 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 122.742 0.417 . . . . 0.0 110.754 -178.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 41.4 t -105.95 128.96 59.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 N-CA-C 108.739 -0.838 . . . . 0.0 108.739 175.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.5 mm-40 -118.33 157.31 27.33 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.64 1.176 . . . . 0.0 109.56 178.039 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -81.88 108.7 15.61 Favored 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 174.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 61.1 t90 . . . . . 0 N--CA 1.469 0.514 0 C-N-CA 122.89 0.476 . . . . 0.0 109.744 178.29 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.659 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 41.2 mt . . . . . 0 N--CA 1.472 0.631 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 11.8 t -58.66 108.08 1.19 Allowed Pre-proline 0 CA--C 1.549 0.935 0 CA-C-O 117.903 -1.046 . . . . 0.0 109.413 168.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -65.9 -13.16 38.53 Favored 'Trans proline' 0 C--N 1.381 2.265 0 C-N-CA 123.148 2.566 . . . . 0.0 113.237 -171.751 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 55.8 mt -67.71 -23.89 30.16 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.499 0 C-N-CA 124.03 0.932 . . . . 0.0 110.902 173.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 59.4 m -131.03 -55.09 1.05 Allowed 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 124.106 0.963 . . . . 0.0 111.235 -170.015 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 26.0 t80 75.69 28.3 0.93 Allowed 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 126.104 1.762 . . . . 0.0 109.907 178.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -104.28 -51.48 3.11 Favored 'General case' 0 CA--C 1.552 1.023 0 CA-C-N 115.469 -0.787 . . . . 0.0 112.246 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 12.2 m-70 -121.93 141.62 34.49 Favored Pre-proline 0 N--CA 1.495 1.806 0 C-N-CA 123.65 0.78 . . . . 0.0 109.948 -173.631 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.659 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 45.8 Cg_endo -84.15 47.26 2.19 Favored 'Trans proline' 0 C--N 1.386 2.539 0 C-N-CA 123.717 2.945 . . . . 0.0 114.796 -171.776 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.429 HG23 ' HB3' ' A' ' 29' ' ' LYS . 77.6 mt 68.21 143.63 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.352 0 C-N-CA 125.164 1.386 . . . . 0.0 112.649 172.273 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.0 t -155.11 19.9 0.43 Allowed 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 122.721 0.408 . . . . 0.0 111.144 176.091 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.471 ' HB3' ' HD2' ' A' ' 32' ' ' LYS . . . -139.97 132.23 28.24 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 122.879 0.472 . . . . 0.0 109.8 176.211 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.4 p -113.24 132.98 60.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 C-N-CA 123.486 0.714 . . . . 0.0 109.236 173.066 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 14.5 m-85 -87.84 90.49 8.4 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 -178.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -73.2 136.93 78.77 Favored Pre-proline 0 CA--C 1.553 1.089 0 CA-C-N 114.136 -1.393 . . . . 0.0 109.89 -178.215 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -98.15 20.34 26.46 Favored 'Cis proline' 0 C--N 1.374 1.911 0 N-CA-C 114.595 0.96 . . . . 0.0 114.595 -3.085 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 41.5 t -62.67 -65.6 0.66 Allowed 'General case' 0 N--CA 1.482 1.126 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -175.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 128.86 -25.68 4.63 Favored Glycine 0 C--N 1.35 1.347 0 CA-C-O 119.553 -0.582 . . . . 0.0 113.465 -178.001 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.638 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 26.4 m80 -63.06 147.78 49.72 Favored 'General case' 0 N--CA 1.484 1.259 0 CA-C-N 117.212 0.506 . . . . 0.0 109.64 171.077 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.429 ' HB3' HG23 ' A' ' 19' ' ' ILE . 96.1 mttt -133.95 168.92 17.9 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.926 0.89 . . . . 0.0 110.41 -173.567 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 21.2 t -168.81 177.57 4.99 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.604 0.762 . . . . 0.0 110.662 177.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 12.8 p -80.45 153.74 28.05 Favored 'General case' 0 C--O 1.246 0.876 0 CA-C-N 115.573 -0.739 . . . . 0.0 109.217 175.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.471 ' HD2' ' HB3' ' A' ' 21' ' ' ALA . 14.9 mmmm -57.96 -39.68 78.73 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.801 0.84 . . . . 0.0 112.366 -172.522 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -64.65 -35.95 82.69 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.783 0.833 . . . . 0.0 112.293 -176.246 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.8 m -59.0 -56.52 21.26 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.05 0.54 . . . . 0.0 111.238 177.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 8.4 tp -76.1 -31.32 21.42 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 CA-C-N 115.483 -0.78 . . . . 0.0 111.398 -172.115 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -63.73 -40.22 96.21 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-O 121.0 0.429 . . . . 0.0 110.465 177.138 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -76.12 -35.29 59.34 Favored 'General case' 0 CA--C 1.547 0.851 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.834 176.16 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 84.5 t60 -67.4 -42.97 82.43 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.371 0.668 . . . . 0.0 110.977 -175.277 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 67.9 mt -58.89 -23.88 61.56 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 124.234 1.013 . . . . 0.0 112.573 -177.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 55.0 mtt -66.98 -32.42 73.64 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 123.515 0.726 . . . . 0.0 110.756 176.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -100.73 -67.9 0.84 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 124.278 1.031 . . . . 0.0 110.559 179.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -124.49 156.66 36.88 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 124.019 0.928 . . . . 0.0 111.479 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 32.1 mtmm -102.45 17.47 23.5 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.247 0.619 . . . . 0.0 110.213 176.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 42.0 m-20 -88.18 151.74 22.48 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.499 0.72 . . . . 0.0 112.18 -169.151 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.638 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 39.2 t -88.64 58.7 4.78 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.658 0.783 . . . . 0.0 111.408 -177.069 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 42.97 -85.93 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 126.636 1.974 . . . . 0.0 115.094 171.347 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 53.1 m-85 -73.18 -38.23 66.24 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.384 1.074 . . . . 0.0 111.426 -165.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 16.2 p -102.63 -12.65 17.56 Favored 'General case' 0 N--CA 1.483 1.201 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.506 179.355 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? 54.26 17.74 1.6 Allowed 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 125.759 1.623 . . . . 0.0 113.691 -176.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 31.1 m -64.91 116.26 6.2 Favored 'General case' 0 C--N 1.35 0.594 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 174.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 13.1 m -60.13 116.15 3.99 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 122.879 0.472 . . . . 0.0 110.561 -173.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.424 HG21 HG21 ' A' ' 55' ' ' VAL . 37.6 mt -66.9 127.43 28.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 C-N-CA 124.733 1.213 . . . . 0.0 110.595 -171.537 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 29.0 t -80.89 -41.72 19.77 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.585 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 47.5 t -146.35 133.48 20.43 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.4 0.68 . . . . 0.0 109.483 177.398 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.424 HG21 HG21 ' A' ' 52' ' ' ILE . 45.9 t -98.54 104.14 15.59 Favored 'Isoleucine or valine' 0 C--O 1.245 0.853 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 172.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -91.29 143.66 26.41 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 122.785 0.434 . . . . 0.0 110.251 -178.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -76.77 108.44 9.79 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 173.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 37.6 t90 . . . . . 0 CA--C 1.541 0.618 0 C-N-CA 123.79 0.836 . . . . 0.0 110.696 -176.245 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.583 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 35.4 mt . . . . . 0 CA--C 1.542 0.644 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 40.6 t -58.68 115.79 12.99 Favored Pre-proline 0 CA--C 1.549 0.937 0 CA-C-O 117.844 -1.074 . . . . 0.0 108.65 171.366 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_exo -52.56 -30.09 43.39 Favored 'Trans proline' 0 N--CA 1.506 2.212 0 C-N-CA 123.12 2.546 . . . . 0.0 114.066 -171.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 4.2 mp -77.04 -37.72 26.86 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.072 0 C-N-CA 124.109 0.964 . . . . 0.0 110.973 -177.339 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 73.9 m -106.07 -47.34 3.86 Favored 'General case' 0 N--CA 1.485 1.28 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 -167.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.421 ' HA ' ' HB3' ' A' ' 10' ' ' LEU . 53.4 m-85 77.78 -51.89 0.52 Allowed 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 126.637 1.975 . . . . 0.0 111.638 -174.898 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.13 -5.68 14.49 Favored 'General case' 0 N--CA 1.484 1.265 0 N-CA-C 114.374 1.25 . . . . 0.0 114.374 -170.35 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 28.1 m170 -135.58 132.88 19.91 Favored Pre-proline 0 N--CA 1.483 1.218 0 C-N-CA 123.412 0.685 . . . . 0.0 109.384 172.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.583 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 42.2 Cg_endo -86.2 71.31 4.18 Favored 'Trans proline' 0 C--N 1.377 2.054 0 C-N-CA 123.46 2.773 . . . . 0.0 114.386 -173.527 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 81.9 mt 61.88 170.42 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.499 2.024 0 C-N-CA 124.27 1.028 . . . . 0.0 111.017 176.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 70.3 m -156.31 -37.91 0.08 Allowed 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 124.074 0.95 . . . . 0.0 110.188 173.337 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -127.28 171.51 11.41 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.093 0.957 . . . . 0.0 111.24 -174.309 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 4.8 p -141.56 140.11 31.39 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 C-N-CA 124.305 1.042 . . . . 0.0 109.443 -179.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -88.3 96.4 10.56 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 124.202 1.001 . . . . 0.0 108.878 -178.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.7 tp60 -92.75 145.92 31.22 Favored Pre-proline 0 CA--C 1.555 1.137 0 CA-C-N 114.802 -1.09 . . . . 0.0 109.658 -174.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -93.59 37.53 5.92 Favored 'Cis proline' 0 C--N 1.378 2.091 0 CA-C-N 120.035 1.048 . . . . 0.0 114.431 -2.384 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 19.3 t -75.66 -78.64 0.11 Allowed 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 122.539 0.336 . . . . 0.0 111.399 176.021 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 141.44 -26.5 2.42 Favored Glycine 0 C--N 1.357 1.702 0 CA-C-O 119.724 -0.487 . . . . 0.0 113.198 -173.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.426 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 16.5 m80 -59.57 136.57 58.03 Favored 'General case' 0 N--CA 1.487 1.391 0 CA-C-N 117.144 0.472 . . . . 0.0 110.456 173.748 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -122.74 154.19 38.47 Favored 'General case' 0 C--O 1.238 0.447 0 C-N-CA 123.682 0.793 . . . . 0.0 110.445 -176.054 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 27.0 t -164.28 -168.91 1.66 Allowed 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.655 1.182 . . . . 0.0 107.842 -179.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 20.8 p -101.82 164.97 11.45 Favored 'General case' 0 N--CA 1.477 0.92 0 O-C-N 121.619 -0.676 . . . . 0.0 110.979 -179.465 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt -55.12 -42.84 73.47 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 124.576 1.151 . . . . 0.0 110.986 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.89 -44.84 94.01 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.743 0.817 . . . . 0.0 112.266 -177.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 7.0 m -58.57 -53.56 56.98 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 123.67 0.788 . . . . 0.0 112.195 -179.22 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 5.6 tp -70.75 -39.39 75.57 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.096 -174.22 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -61.95 -35.88 79.76 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.32 0.648 . . . . 0.0 110.858 177.488 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -73.67 -40.41 63.71 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 124.054 0.942 . . . . 0.0 110.935 176.343 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 77.2 t60 -66.61 -38.77 87.65 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.3 1.04 . . . . 0.0 111.799 -176.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 78.5 mt -62.79 -17.14 60.66 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.83 0.852 . . . . 0.0 112.91 -175.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 83.0 mtp -67.4 -31.25 71.33 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.432 0.693 . . . . 0.0 111.35 174.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 43.2 t-20 -104.38 -68.58 0.84 Allowed 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.7 m-80 -120.89 169.54 10.35 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 123.359 0.664 . . . . 0.0 111.119 -175.296 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 58.6 mmtt -111.25 10.75 21.74 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.396 0.678 . . . . 0.0 109.887 179.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 61.3 m-20 -85.5 163.88 18.16 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.726 0.811 . . . . 0.0 113.179 -168.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.426 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 42.0 t -92.75 61.14 3.55 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.467 0.707 . . . . 0.0 111.559 -176.698 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 47.37 -81.48 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 125.869 1.668 . . . . 0.0 114.298 164.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 47.7 m-85 -79.05 -46.61 17.77 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.368 1.067 . . . . 0.0 111.057 -170.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 15.5 p -100.18 -7.02 25.25 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 122.596 0.358 . . . . 0.0 111.498 -177.123 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 58.73 21.82 9.32 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 124.845 1.258 . . . . 0.0 113.623 176.149 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 29.5 m -72.91 124.77 26.1 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 174.35 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 28.5 m -60.23 115.8 3.77 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-O 120.907 0.384 . . . . 0.0 110.038 -178.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.449 HG22 HG23 ' A' ' 55' ' ' VAL . 38.7 mt -71.51 125.62 30.34 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 124.126 0.97 . . . . 0.0 110.624 -171.554 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 36.7 t -85.88 -41.47 15.32 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.774 0 C-N-CA 123.227 0.611 . . . . 0.0 109.678 -178.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 48.0 m -147.97 145.44 28.55 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.501 0.721 . . . . 0.0 110.024 178.194 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.449 HG23 HG22 ' A' ' 52' ' ' ILE . 38.3 t -115.11 104.62 17.15 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 175.4 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -88.64 144.48 26.26 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 110.065 -0.346 . . . . 0.0 110.065 179.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -73.8 103.74 4.45 Favored 'General case' 0 C--O 1.238 0.463 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 172.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 53.5 t90 . . . . . 0 CA--C 1.541 0.616 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 178.512 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.525 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 48.2 mt . . . . . 0 CA--C 1.538 0.496 0 CA-C-O 119.949 -0.072 . . . . 0.0 111.159 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 46.4 t -53.07 109.29 1.39 Allowed Pre-proline 0 C--N 1.352 0.685 0 O-C-N 124.375 1.047 . . . . 0.0 109.51 172.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -56.39 -31.05 83.94 Favored 'Trans proline' 0 C--N 1.373 1.832 0 C-N-CA 122.905 2.403 . . . . 0.0 113.376 -172.689 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 55.6 mt -66.56 -39.01 82.86 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.004 0 C-N-CA 124.262 1.025 . . . . 0.0 111.5 -179.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 82.5 m -106.87 -24.87 11.91 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.415 0.686 . . . . 0.0 112.68 -170.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 90.8 m-85 67.27 -60.44 0.37 Allowed 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 126.098 1.759 . . . . 0.0 112.86 -170.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.34 -44.13 92.69 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 114.791 1.404 . . . . 0.0 114.791 -165.241 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 54.4 m170 -104.37 150.84 38.88 Favored Pre-proline 0 N--CA 1.485 1.295 0 C-N-CA 123.179 0.591 . . . . 0.0 109.68 -175.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.525 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 84.0 Cg_endo -75.39 -164.42 0.24 Allowed 'Trans proline' 0 C--N 1.373 1.864 0 C-N-CA 123.049 2.5 . . . . 0.0 113.685 -179.063 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 97.4 mt -78.91 131.59 34.05 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.638 173.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 38.7 t -128.13 -5.84 5.5 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.188 0.995 . . . . 0.0 110.497 179.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -150.68 158.24 43.92 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.273 0.629 . . . . 0.0 111.309 -176.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.1 p -137.64 122.91 24.85 Favored 'Isoleucine or valine' 0 C--O 1.245 0.828 0 C-N-CA 124.293 1.037 . . . . 0.0 109.016 178.122 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.0 m-30 -75.23 86.09 2.44 Favored 'General case' 0 C--O 1.241 0.606 0 CA-C-N 115.167 -0.924 . . . . 0.0 108.674 178.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 11.4 mt-30 -87.83 146.47 38.96 Favored Pre-proline 0 CA--C 1.543 0.711 0 C-N-CA 122.87 0.468 . . . . 0.0 111.203 -174.513 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_endo -92.17 17.99 40.68 Favored 'Cis proline' 0 C--N 1.371 1.734 0 C-N-CA 124.859 -0.892 . . . . 0.0 114.094 3.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 27.4 t -72.29 -27.5 62.5 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 111.879 0.326 . . . . 0.0 111.879 -173.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 90.74 -16.85 57.21 Favored Glycine 0 C--N 1.347 1.179 0 CA-C-O 119.357 -0.69 . . . . 0.0 114.458 175.246 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 5.9 m80 -61.94 120.06 10.05 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.15 0.58 . . . . 0.0 110.26 175.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 52.5 mttp -110.13 159.47 17.32 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.563 0.697 . . . . 0.0 111.763 -174.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 93.0 p -166.37 -164.57 0.68 Allowed 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 114.183 -1.371 . . . . 0.0 107.894 173.266 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 16.3 p -86.24 154.17 21.47 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 171.015 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -67.55 -28.81 68.11 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.214 0.606 . . . . 0.0 110.239 -175.38 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -56.95 -41.54 78.45 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.766 0.826 . . . . 0.0 112.012 175.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.8 m -55.23 -59.26 5.03 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.511 0.724 . . . . 0.0 110.994 177.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.68 HG21 HG11 ' A' ' 55' ' ' VAL . 10.4 tp -73.79 -22.55 18.67 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.763 0 CA-C-N 115.3 -0.863 . . . . 0.0 111.599 -173.263 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -64.49 -42.26 95.97 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 122.802 0.441 . . . . 0.0 109.853 178.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 22.7 tm0? -74.69 -34.71 62.71 Favored 'General case' 0 CA--C 1.552 1.048 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.41 176.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.502 ' HB3' HD13 ' A' ' 35' ' ' ILE . 41.5 t60 -67.21 -39.93 86.36 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.829 0.852 . . . . 0.0 111.333 -177.69 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 72.7 mt -73.99 -0.89 17.66 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 123.7 0.8 . . . . 0.0 112.82 -177.333 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 64.1 mtt -72.85 -14.31 61.47 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 123.074 0.55 . . . . 0.0 111.245 174.007 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -149.41 -57.58 0.2 Allowed 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.633 0.773 . . . . 0.0 109.621 174.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 36.4 m-20 -79.68 172.59 13.58 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.914 0.886 . . . . 0.0 110.71 -175.086 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -159.69 54.18 0.37 Allowed 'General case' 0 N--CA 1.484 1.227 0 CA-C-O 122.073 0.94 . . . . 0.0 109.204 -176.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -155.14 174.27 15.43 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.21 -172.031 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 96.9 m -70.6 137.17 49.76 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.87 172.36 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 71.0 m-85 -58.43 -36.12 73.15 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-O 121.198 0.523 . . . . 0.0 109.854 167.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -76.91 -75.23 0.21 Allowed 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 124.625 1.17 . . . . 0.0 111.705 -172.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 7.2 p -91.98 -8.25 46.66 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.136 0.575 . . . . 0.0 112.368 -170.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 66.56 18.3 10.76 Favored 'General case' 0 CA--C 1.572 1.803 0 C-N-CA 124.287 1.035 . . . . 0.0 111.786 178.578 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 93.6 m -78.59 129.96 35.38 Favored 'General case' 0 N--CA 1.485 1.304 0 O-C-N 121.479 -0.763 . . . . 0.0 110.593 174.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 31.2 m -59.97 134.44 57.04 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.249 1.02 . . . . 0.0 111.123 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.466 HG22 HG22 ' A' ' 55' ' ' VAL . 22.0 mt -93.24 135.49 27.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 123.355 0.662 . . . . 0.0 109.94 -177.622 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 77.2 t -79.66 -46.37 22.75 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 C-N-CA 123.106 0.562 . . . . 0.0 109.549 174.223 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 47.1 p -160.33 134.71 7.42 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.035 0.534 . . . . 0.0 110.057 179.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.68 HG11 HG21 ' A' ' 35' ' ' ILE . 36.9 t -98.21 105.16 16.88 Favored 'Isoleucine or valine' 0 C--O 1.243 0.762 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 177.807 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -86.06 143.09 28.27 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 176.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -71.3 123.94 23.4 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 172.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 32.4 t90 . . . . . 0 C--O 1.242 0.698 0 CA-C-O 121.081 0.467 . . . . 0.0 111.102 -171.753 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.425 HD12 ' O ' ' A' ' 15' ' ' TYR . 75.2 mt . . . . . 0 N--CA 1.473 0.713 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 52.4 t -55.04 120.75 31.54 Favored Pre-proline 0 CA--C 1.555 1.155 0 CA-C-O 118.71 -0.662 . . . . 0.0 111.241 -177.263 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -58.1 -27.76 81.09 Favored 'Trans proline' 0 C--N 1.387 2.569 0 C-N-CA 123.236 2.624 . . . . 0.0 113.248 -172.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.5 mp -77.49 -47.15 26.76 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.939 0 CA-C-N 114.642 -1.163 . . . . 0.0 110.331 179.09 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 74.3 m -95.61 -59.15 1.93 Allowed 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.354 0.661 . . . . 0.0 111.85 -166.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.425 ' O ' HD12 ' A' ' 10' ' ' LEU . 22.6 m-85 75.19 -39.37 0.4 Allowed 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 125.72 1.608 . . . . 0.0 113.09 -172.865 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.57 -8.43 53.98 Favored 'General case' 0 N--CA 1.486 1.341 0 CA-C-N 118.812 0.733 . . . . 0.0 112.339 -179.213 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 70.0 m80 -142.09 153.54 63.69 Favored Pre-proline 0 CA--C 1.555 1.161 0 C-N-CA 124.003 0.921 . . . . 0.0 108.639 175.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -79.09 -159.63 0.11 Allowed 'Trans proline' 0 C--N 1.382 2.335 0 C-N-CA 123.289 2.659 . . . . 0.0 113.421 -177.112 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.413 HG23 ' HB3' ' A' ' 29' ' ' LYS . 53.7 mt -98.87 133.52 41.15 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 C-N-CA 124.188 0.995 . . . . 0.0 110.095 176.415 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 50.1 m -137.4 18.0 2.93 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.196 0.998 . . . . 0.0 110.593 -179.491 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.413 ' HA ' ' O ' ' A' ' 56' ' ' GLU . . . -154.09 141.03 19.25 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.182 0.593 . . . . 0.0 110.747 -176.359 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 6.9 p -123.51 133.21 69.81 Favored 'Isoleucine or valine' 0 C--O 1.241 0.607 0 C-N-CA 123.522 0.729 . . . . 0.0 109.208 173.626 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -86.96 91.24 8.62 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-N 115.182 -0.917 . . . . 0.0 108.606 -179.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -83.07 141.99 43.93 Favored Pre-proline 0 CA--C 1.552 1.023 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.389 -171.36 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_endo -97.49 23.62 23.46 Favored 'Cis proline' 0 C--N 1.377 2.031 0 CA-C-N 119.369 0.81 . . . . 0.0 113.2 -1.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 43.0 t -63.34 -55.4 24.86 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.313 0.645 . . . . 0.0 111.757 -176.101 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 117.09 -25.31 8.87 Favored Glycine 0 C--N 1.345 1.074 0 CA-C-O 119.351 -0.694 . . . . 0.0 113.681 -179.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.431 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 19.9 m170 -58.64 141.53 52.16 Favored 'General case' 0 N--CA 1.484 1.256 0 CA-C-N 117.43 0.615 . . . . 0.0 109.566 172.087 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.413 ' HB3' HG23 ' A' ' 19' ' ' ILE . 53.9 mttp -132.63 165.09 25.23 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.004 0.522 . . . . 0.0 110.747 -174.389 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 42.9 t -172.18 -179.87 2.43 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.258 1.423 . . . . 0.0 107.909 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 13.9 p -78.24 150.13 33.5 Favored 'General case' 0 C--O 1.245 0.848 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 171.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -60.6 -38.12 83.63 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 122.922 0.489 . . . . 0.0 111.827 -175.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.41 -32.05 69.82 Favored 'General case' 0 CA--C 1.554 1.133 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -176.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.1 m -61.33 -58.43 8.28 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 123.454 0.702 . . . . 0.0 111.139 172.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.534 HG23 HG11 ' A' ' 55' ' ' VAL . 7.0 tp -69.37 -30.4 45.62 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 O-C-N 123.285 0.366 . . . . 0.0 111.295 -173.009 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 61.0 t30 -63.38 -45.7 89.9 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 175.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -65.79 -33.57 76.16 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.853 0.861 . . . . 0.0 110.509 175.018 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.429 ' HA ' HD21 ' A' ' 41' ' ' ASN . 69.9 t60 -71.42 -32.78 68.78 Favored 'General case' 0 C--O 1.217 -0.644 0 C-N-CA 123.584 0.753 . . . . 0.0 110.372 -179.342 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 90.9 mt -66.61 -9.57 36.84 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 123.629 0.772 . . . . 0.0 111.913 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 82.2 mtp -76.69 -41.74 44.24 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 122.979 0.512 . . . . 0.0 109.732 168.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.429 HD21 ' HA ' ' A' ' 38' ' ' HIS . 23.4 m-80 -76.09 -70.41 0.44 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.039 0.935 . . . . 0.0 110.294 179.412 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 -143.87 167.39 22.44 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 125.121 1.368 . . . . 0.0 109.271 -177.242 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -98.33 21.2 11.35 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-O 121.813 0.816 . . . . 0.0 110.31 175.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -90.37 166.26 13.39 Favored 'General case' 0 CA--C 1.545 0.75 0 CA-C-O 121.811 0.815 . . . . 0.0 112.778 -173.066 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.431 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 43.6 t -96.02 54.35 1.46 Allowed 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 115.287 -0.87 . . . . 0.0 111.245 -171.662 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 49.68 -84.61 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 125.777 1.631 . . . . 0.0 113.649 174.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 40.3 m-85 -74.73 -65.4 0.87 Allowed 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.605 1.162 . . . . 0.0 109.937 -169.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 14.0 p -75.07 -17.08 60.53 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 122.535 0.334 . . . . 0.0 111.215 -177.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 52.1 mttp 65.34 23.56 12.07 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 125.299 1.44 . . . . 0.0 113.372 176.329 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 36.2 m -69.09 128.31 36.2 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 122.563 0.345 . . . . 0.0 110.173 174.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 18.0 m -62.27 110.68 1.71 Allowed 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 176.303 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 42.0 mt -70.98 135.14 28.68 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 124.131 0.972 . . . . 0.0 110.977 -172.604 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 60.1 t -78.19 -51.76 17.08 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 C-N-CA 122.97 0.508 . . . . 0.0 109.701 177.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 50.3 m -149.91 151.51 33.53 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 -179.127 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.534 HG11 HG23 ' A' ' 35' ' ' ILE . 47.6 t -121.23 110.21 27.31 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.11 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 177.674 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.413 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 1.6 mp0 -92.91 154.59 18.11 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 122.909 0.484 . . . . 0.0 110.785 179.517 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -67.63 96.6 0.55 Allowed 'General case' 0 C--O 1.241 0.631 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 168.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 52.9 t90 . . . . . 0 C--O 1.238 0.454 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 176.581 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.638 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 79.4 mt . . . . . 0 CA--C 1.54 0.574 0 N-CA-C 111.497 0.184 . . . . 0.0 111.497 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 46.0 t -59.82 119.15 38.4 Favored Pre-proline 0 CA--C 1.545 0.781 0 CA-C-O 118.208 -0.901 . . . . 0.0 108.773 172.122 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -59.81 -28.17 86.61 Favored 'Trans proline' 0 C--N 1.374 1.92 0 C-N-CA 122.586 2.191 . . . . 0.0 112.39 -175.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 69.6 mt -72.05 -32.61 44.36 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.099 0 C-N-CA 124.758 1.223 . . . . 0.0 112.201 -179.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 79.0 m -118.37 -50.61 2.44 Favored 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -167.091 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 80.39 -42.42 0.22 Allowed 'General case' 0 N--CA 1.498 1.946 0 C-N-CA 126.594 1.958 . . . . 0.0 112.445 -179.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.95 -33.32 71.76 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.444 0.698 . . . . 0.0 112.606 -176.343 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 11.6 m170 -125.14 155.33 71.2 Favored Pre-proline 0 N--CA 1.485 1.289 0 C-N-CA 124.099 0.96 . . . . 0.0 109.196 -179.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.638 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 95.0 Cg_endo -75.64 -163.51 0.2 Allowed 'Trans proline' 0 C--N 1.38 2.224 0 C-N-CA 122.914 2.41 . . . . 0.0 113.401 -176.332 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 86.8 mt -89.11 142.72 12.48 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 C-N-CA 123.833 0.853 . . . . 0.0 108.869 171.275 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 39.7 t -129.2 -16.73 3.95 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.479 0.712 . . . . 0.0 110.785 178.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -145.58 133.02 20.72 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -168.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.6 p -102.5 143.07 15.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 124.892 1.277 . . . . 0.0 109.542 169.409 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 18.5 m-85 -99.13 85.62 3.27 Favored 'General case' 0 C--O 1.242 0.674 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 176.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.486 ' NE2' ' HG3' ' A' ' 56' ' ' GLU . 10.1 tt0 -82.77 143.44 46.73 Favored Pre-proline 0 CA--C 1.553 1.088 0 CA-C-N 114.157 -1.383 . . . . 0.0 108.944 -174.096 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -92.41 13.64 50.37 Favored 'Cis proline' 0 C--N 1.386 2.524 0 N-CA-C 115.925 1.471 . . . . 0.0 115.925 1.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 50.8 t -62.03 -53.78 50.8 Favored 'General case' 0 N--CA 1.484 1.251 0 CA-C-N 118.55 0.614 . . . . 0.0 111.798 -177.546 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 129.43 -43.05 1.35 Allowed Glycine 0 C--N 1.347 1.176 0 CA-C-O 119.15 -0.806 . . . . 0.0 113.297 177.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.647 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 34.5 m80 -52.16 136.01 30.79 Favored 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 123.426 0.69 . . . . 0.0 112.572 -177.361 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 6.2 mptt -118.49 168.88 10.26 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.514 0.726 . . . . 0.0 110.997 178.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 96.9 p -170.2 -176.07 2.14 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.068 1.347 . . . . 0.0 107.738 171.057 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 17.8 p -72.63 146.69 46.43 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 168.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 35.2 ttpt -70.31 -16.87 63.05 Favored 'General case' 0 N--CA 1.483 1.213 0 CA-C-O 121.079 0.466 . . . . 0.0 110.882 -175.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.91 -39.94 91.23 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 123.646 0.779 . . . . 0.0 111.299 170.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.5 m -56.42 -52.42 64.72 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.761 0.824 . . . . 0.0 111.297 178.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.444 HD11 HG13 ' A' ' 52' ' ' ILE . 9.7 tp -71.36 -32.78 47.89 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 O-C-N 123.398 0.436 . . . . 0.0 111.04 -174.753 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -59.13 -47.96 83.36 Favored 'General case' 0 N--CA 1.484 1.242 0 CA-C-O 121.104 0.478 . . . . 0.0 110.237 173.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -73.3 -21.61 60.54 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 115.035 -0.984 . . . . 0.0 111.699 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 46.7 t60 -77.66 -37.43 49.87 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.557 0.743 . . . . 0.0 110.163 177.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 96.1 mt -73.77 0.73 12.19 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 124.025 0.93 . . . . 0.0 111.648 179.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 23.5 mmt -78.8 -14.94 58.98 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 124.134 0.973 . . . . 0.0 110.408 169.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -134.83 -70.42 0.5 Allowed 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 123.855 0.862 . . . . 0.0 109.854 179.185 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -102.25 -174.83 2.67 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 124.064 0.946 . . . . 0.0 111.873 -174.058 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -144.93 64.82 1.28 Allowed 'General case' 0 C--N 1.349 0.587 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 175.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.452 ' HB3' ' HA ' ' A' ' 49' ' ' LYS . 18.5 m-20 -137.65 159.93 40.6 Favored 'General case' 0 N--CA 1.483 1.202 0 CA-C-O 121.736 0.779 . . . . 0.0 111.295 -169.436 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.647 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 21.8 t -94.51 37.0 1.13 Allowed 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 124.891 1.276 . . . . 0.0 111.194 -172.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 58.65 -86.32 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 125.04 1.336 . . . . 0.0 113.65 169.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 -87.66 44.71 1.21 Allowed 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 124.871 1.268 . . . . 0.0 112.664 -167.044 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 23.5 p 175.8 -31.96 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 126.093 1.757 . . . . 0.0 107.885 -178.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.452 ' HA ' ' HB3' ' A' ' 44' ' ' ASP . 9.9 mtmp? 63.1 38.65 10.61 Favored 'General case' 0 C--N 1.365 1.258 0 C-N-CA 125.301 1.441 . . . . 0.0 111.999 -178.017 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 8.0 m -71.97 129.21 38.0 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 166.664 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 47.9 m -57.09 131.99 51.57 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 123.093 0.557 . . . . 0.0 110.551 178.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.444 HG13 HD11 ' A' ' 35' ' ' ILE . 38.0 mm -63.09 113.43 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 123.083 0.553 . . . . 0.0 111.051 -175.118 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 75.1 t -77.13 -56.76 7.14 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 170.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 62.6 m -153.21 136.17 15.48 Favored 'General case' 0 C--O 1.246 0.903 0 C-N-CA 123.312 0.645 . . . . 0.0 111.073 177.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 59.9 t -95.26 105.01 16.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 123.973 0.909 . . . . 0.0 108.667 170.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.486 ' HG3' ' NE2' ' A' ' 24' ' ' GLN . 23.6 mm-40 -97.26 146.75 24.82 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 172.649 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -75.29 112.17 11.31 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 172.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 57.7 t90 . . . . . 0 CA--C 1.544 0.741 0 C-N-CA 123.415 0.686 . . . . 0.0 111.218 -174.136 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.662 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 85.1 mt . . . . . 0 N--CA 1.471 0.598 0 CA-C-O 120.573 0.225 . . . . 0.0 111.197 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 41.2 t -60.32 118.66 35.65 Favored Pre-proline 0 CA--C 1.545 0.77 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.486 173.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -65.92 -15.16 47.8 Favored 'Trans proline' 0 N--CA 1.5 1.877 0 C-N-CA 122.549 2.166 . . . . 0.0 113.013 -174.352 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 43.8 mt -85.96 -20.06 8.15 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.205 0 C-N-CA 124.478 1.111 . . . . 0.0 111.034 -178.462 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 39.8 m -134.39 -51.62 0.81 Allowed 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -169.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 78.95 -40.08 0.24 Allowed 'General case' 0 N--CA 1.498 1.954 0 C-N-CA 126.194 1.798 . . . . 0.0 112.981 -178.345 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.18 -14.66 56.73 Favored 'General case' 0 CA--C 1.559 1.3 0 N-CA-C 113.121 0.786 . . . . 0.0 113.121 -177.083 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 57.7 m-70 -137.77 150.36 67.6 Favored Pre-proline 0 N--CA 1.485 1.288 0 C-N-CA 124.049 0.94 . . . . 0.0 109.458 172.123 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.662 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 87.6 Cg_endo -76.02 -165.7 0.32 Allowed 'Trans proline' 0 C--N 1.382 2.341 0 C-N-CA 123.144 2.563 . . . . 0.0 113.762 178.107 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 65.9 mt -78.29 149.28 5.83 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.93 0 C-N-CA 123.448 0.699 . . . . 0.0 110.445 175.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.6 m -136.13 -32.65 0.86 Allowed 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.628 0.771 . . . . 0.0 111.079 -179.213 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -130.21 152.9 49.14 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.547 0.739 . . . . 0.0 111.584 -170.26 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.43 HG12 HE22 ' A' ' 24' ' ' GLN . 7.2 p -128.53 138.69 53.94 Favored 'Isoleucine or valine' 0 C--O 1.244 0.771 0 C-N-CA 124.828 1.251 . . . . 0.0 108.29 176.066 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 19.0 m-85 -107.27 105.62 15.68 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.094 0.558 . . . . 0.0 110.782 -169.305 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.43 HE22 HG12 ' A' ' 22' ' ' VAL . 2.9 mp0 -82.6 149.37 60.57 Favored Pre-proline 0 N--CA 1.474 0.735 0 C-N-CA 123.976 0.91 . . . . 0.0 110.469 174.804 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -97.15 81.64 0.13 OUTLIER 'Cis proline' 0 C--N 1.369 1.619 0 CA-C-N 118.853 0.626 . . . . 0.0 110.871 -3.304 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 36.6 t -143.11 -64.52 0.4 Allowed 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.861 -0.609 . . . . 0.0 112.127 -175.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 114.96 -12.03 20.28 Favored Glycine 0 C--N 1.345 1.032 0 CA-C-O 118.884 -0.953 . . . . 0.0 113.79 -176.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.414 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 6.1 m170 -58.31 139.42 55.25 Favored 'General case' 0 N--CA 1.491 1.606 0 CA-C-N 118.17 0.985 . . . . 0.0 110.207 171.541 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 57.4 mttp -130.41 156.28 45.0 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.318 0.647 . . . . 0.0 110.729 -174.136 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 92.9 p -169.0 -179.39 3.62 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.27 1.028 . . . . 0.0 109.11 174.028 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 13.6 p -69.04 148.91 49.37 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 173.331 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -71.03 -18.16 62.59 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-N 117.859 0.3 . . . . 0.0 111.667 -174.53 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.17 -34.38 74.95 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 122.369 0.268 . . . . 0.0 111.47 171.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.7 m -60.86 -51.72 68.11 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.496 0.718 . . . . 0.0 111.243 177.223 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.416 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 10.0 tp -71.33 -31.81 44.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 O-C-N 123.236 0.335 . . . . 0.0 110.849 -176.67 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 4.7 t30 -60.93 -46.49 90.46 Favored 'General case' 0 N--CA 1.48 1.05 0 CA-C-O 121.288 0.566 . . . . 0.0 109.967 174.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 63.7 tt0 -72.09 -27.12 62.45 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.083 178.537 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 47.3 t60 -77.17 -39.24 49.7 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 122.802 0.441 . . . . 0.0 110.674 -177.777 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.416 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 69.6 mt -66.33 -25.44 66.82 Favored 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 112.828 0.677 . . . . 0.0 112.828 -173.276 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 26.6 ptm -75.19 -14.15 60.52 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 122.541 0.336 . . . . 0.0 111.482 175.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 46.1 m-80 -105.87 -67.22 0.94 Allowed 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.203 0.601 . . . . 0.0 110.401 175.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 41.5 m-80 -132.17 -168.37 2.03 Favored 'General case' 0 N--CA 1.49 1.537 0 C-N-CA 124.871 1.268 . . . . 0.0 110.75 -176.054 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 82.4 tttt -135.62 9.41 3.38 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 123.389 0.675 . . . . 0.0 110.776 176.55 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.408 ' HB2' ' HA ' ' A' ' 49' ' ' LYS . 3.7 p30 -74.64 167.61 21.44 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-O 121.336 0.588 . . . . 0.0 111.372 -179.444 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.429 ' HA ' HD13 ' A' ' 52' ' ' ILE . 53.5 t -90.24 52.75 2.31 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.561 0.744 . . . . 0.0 110.877 -177.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 35.6 m-85 54.97 -80.25 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 126.084 1.754 . . . . 0.0 113.262 172.644 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 48.8 m-85 -83.58 -62.69 1.51 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.334 1.054 . . . . 0.0 110.732 -172.214 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 9.4 p -80.34 -7.95 59.29 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 122.829 0.451 . . . . 0.0 111.959 -173.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.408 ' HA ' ' HB2' ' A' ' 44' ' ' ASP . 74.4 mmtt 67.99 11.52 8.4 Favored 'General case' 0 N--CA 1.484 1.27 0 N-CA-C 114.583 1.327 . . . . 0.0 114.583 172.686 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 39.3 m -64.12 136.35 57.18 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 122.886 0.474 . . . . 0.0 111.025 176.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 90.0 m -63.06 119.91 10.42 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 122.861 0.464 . . . . 0.0 110.305 176.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.429 HD13 ' HA ' ' A' ' 45' ' ' CYS . 53.3 mt -79.13 104.29 6.96 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.797 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 -178.531 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 88.0 t -75.05 -31.38 24.85 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.818 0 C-N-CA 123.722 0.809 . . . . 0.0 110.735 177.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.3 t -151.7 134.18 15.39 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-O 120.678 0.275 . . . . 0.0 111.036 179.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 59.3 t -105.11 103.42 15.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 171.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -109.28 146.04 34.94 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.094 0.558 . . . . 0.0 110.556 -175.317 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -72.09 106.69 4.43 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.239 0.616 . . . . 0.0 110.347 -177.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 60.3 t90 . . . . . 0 C--O 1.239 0.548 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 176.827 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.651 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 63.1 mt . . . . . 0 CA--C 1.544 0.712 0 N-CA-C 110.755 -0.091 . . . . 0.0 110.755 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.561 ' SG ' ' HB2' ' A' ' 30' ' ' SER . 43.0 t -47.38 112.0 1.87 Allowed Pre-proline 0 N--CA 1.476 0.857 0 C-N-CA 125.291 1.436 . . . . 0.0 110.617 -177.009 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -60.25 -16.66 41.98 Favored 'Trans proline' 0 N--CA 1.506 2.264 0 C-N-CA 123.041 2.494 . . . . 0.0 114.085 -169.137 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 68.4 mt -81.26 -43.13 20.27 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.108 0 C-N-CA 124.052 0.941 . . . . 0.0 110.787 177.16 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 93.1 m -97.69 -41.87 7.9 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 123.864 0.866 . . . . 0.0 112.498 -168.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 75.48 -46.45 0.57 Allowed 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 126.756 2.022 . . . . 0.0 112.333 -176.113 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.05 -37.38 87.38 Favored 'General case' 0 N--CA 1.484 1.256 0 N-CA-C 113.75 1.018 . . . . 0.0 113.75 -173.376 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 44.5 m170 -121.44 152.82 58.52 Favored Pre-proline 0 N--CA 1.484 1.26 0 C-N-CA 123.479 0.711 . . . . 0.0 109.521 -177.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.651 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 49.4 Cg_endo -82.4 -170.28 0.91 Allowed 'Trans proline' 0 C--N 1.379 2.151 0 C-N-CA 123.138 2.559 . . . . 0.0 114.243 -175.273 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 88.8 mt -81.38 140.24 16.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 123.674 0.79 . . . . 0.0 109.965 178.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.0 m -140.64 3.85 1.9 Allowed 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.224 0.61 . . . . 0.0 111.276 -177.104 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -152.92 157.27 40.39 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.116 0.566 . . . . 0.0 112.199 -171.131 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.9 p -135.06 140.27 45.57 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 C-N-CA 124.301 1.041 . . . . 0.0 109.185 174.249 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -99.94 99.45 10.22 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.79 0.836 . . . . 0.0 110.704 -173.459 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -72.59 146.94 89.15 Favored Pre-proline 0 N--CA 1.481 1.109 0 C-N-CA 123.845 0.858 . . . . 0.0 111.559 173.303 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 15.8 Cg_endo -95.24 28.41 17.22 Favored 'Cis proline' 0 C--N 1.377 2.027 0 C-N-CA 125.561 -0.6 . . . . 0.0 112.022 -3.621 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 36.9 t -81.36 -74.81 0.31 Allowed 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.447 0.699 . . . . 0.0 111.611 -176.041 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 136.2 -21.93 3.44 Favored Glycine 0 C--N 1.351 1.381 0 CA-C-O 119.362 -0.688 . . . . 0.0 113.927 -177.31 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.411 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 13.4 m170 -58.93 142.83 49.79 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 123.077 0.551 . . . . 0.0 111.174 178.632 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 53.7 mttm -129.35 145.64 51.35 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.62 0.768 . . . . 0.0 110.817 -169.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.561 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 96.0 p -165.65 -177.3 4.29 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.51 1.124 . . . . 0.0 108.389 173.572 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 14.1 p -66.25 142.83 57.55 Favored 'General case' 0 N--CA 1.478 0.935 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 172.17 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -62.69 -29.88 70.98 Favored 'General case' 0 N--CA 1.487 1.381 0 CA-C-N 117.888 0.313 . . . . 0.0 111.57 -177.288 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -53.85 -30.52 45.82 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.419 1.088 . . . . 0.0 112.633 176.272 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.3 m -59.28 -56.87 16.56 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.702 0.801 . . . . 0.0 111.11 175.758 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.555 HG21 HG12 ' A' ' 55' ' ' VAL . 8.3 tp -76.53 -21.71 15.09 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.68 0 O-C-N 123.351 0.407 . . . . 0.0 110.918 -174.725 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -66.03 -41.78 90.46 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 173.305 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -69.97 -40.78 75.17 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.397 0.679 . . . . 0.0 110.623 173.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.443 ' HB3' HD13 ' A' ' 35' ' ' ILE . 78.5 t60 -70.79 -34.32 71.66 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.97 -172.691 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 54.3 mt -71.06 -10.94 60.61 Favored 'General case' 0 N--CA 1.494 1.749 0 CA-C-N 118.364 0.529 . . . . 0.0 112.277 179.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 52.8 mtt -77.18 -17.4 58.58 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.381 0.673 . . . . 0.0 110.227 170.568 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 30.1 t30 -112.28 -75.12 0.61 Allowed 'General case' 0 CA--C 1.558 1.284 0 C-N-CA 124.929 1.292 . . . . 0.0 110.388 179.338 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -127.27 173.65 9.58 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 124.246 1.018 . . . . 0.0 110.961 -176.785 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -112.04 18.59 18.61 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 122.905 0.482 . . . . 0.0 111.556 -176.65 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -96.16 165.71 12.1 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-O 121.4 0.619 . . . . 0.0 112.595 -169.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.411 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 53.2 t -94.62 46.05 1.13 Allowed 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.791 0.836 . . . . 0.0 111.69 -174.843 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 77.5 m-85 54.19 -82.9 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 125.908 1.683 . . . . 0.0 113.54 172.524 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -71.49 -63.12 1.18 Allowed 'General case' 0 C--N 1.348 0.51 0 C-N-CA 124.32 1.048 . . . . 0.0 110.436 -171.726 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 14.6 p -79.74 -14.54 58.65 Favored 'General case' 0 N--CA 1.484 1.233 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.282 -176.254 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 88.8 mttt 64.31 14.98 9.14 Favored 'General case' 0 N--CA 1.494 1.74 0 C-N-CA 124.996 1.318 . . . . 0.0 113.518 175.681 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 16.8 m -67.77 121.91 16.97 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 174.668 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 35.2 m -62.72 117.37 6.21 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-O 121.198 0.523 . . . . 0.0 110.187 -179.102 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 57.9 mt -72.46 129.88 35.63 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 C-N-CA 124.669 1.188 . . . . 0.0 111.132 -173.282 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 76.3 t -79.62 -55.39 9.33 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 172.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.9 m -137.54 144.91 42.34 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.396 0.678 . . . . 0.0 110.284 -173.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.555 HG12 HG21 ' A' ' 35' ' ' ILE . 56.1 t -117.05 119.07 60.85 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 N-CA-C 108.493 -0.928 . . . . 0.0 108.493 171.389 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -99.92 168.32 9.95 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 122.999 0.52 . . . . 0.0 110.525 174.362 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -93.69 101.03 13.15 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 174.223 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 29.8 t90 . . . . . 0 CA--C 1.545 0.768 0 CA-C-O 120.87 0.367 . . . . 0.0 110.955 -174.092 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 81.4 mt . . . . . 0 C--O 1.239 0.548 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.437 ' SG ' ' HB2' ' A' ' 30' ' ' SER . 51.9 t -56.52 112.57 4.63 Favored Pre-proline 0 N--CA 1.484 1.251 0 CA-C-O 118.74 -0.647 . . . . 0.0 110.079 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -61.08 -17.18 50.53 Favored 'Trans proline' 0 C--N 1.377 2.078 0 C-N-CA 123.307 2.671 . . . . 0.0 113.375 -172.257 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 68.9 mt -84.55 -48.45 16.71 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.064 0 C-N-CA 124.031 0.932 . . . . 0.0 110.906 176.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 90.1 m -86.41 -53.24 5.12 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.152 0.581 . . . . 0.0 111.801 -171.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 78.39 -40.32 0.28 Allowed 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 126.515 1.926 . . . . 0.0 112.329 -175.303 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -78.0 -10.71 59.73 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 113.093 0.775 . . . . 0.0 113.093 -176.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -139.96 154.31 70.4 Favored Pre-proline 0 N--CA 1.483 1.206 0 C-N-CA 123.851 0.86 . . . . 0.0 109.383 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_endo -77.15 -173.69 1.89 Allowed 'Trans proline' 0 C--N 1.38 2.192 0 C-N-CA 123.045 2.497 . . . . 0.0 114.232 -174.334 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.47 HG22 ' HB3' ' A' ' 29' ' ' LYS . 67.5 mt -89.27 143.33 11.39 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.807 0 CA-C-N 114.767 -1.106 . . . . 0.0 109.659 175.586 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 78.4 p -150.13 19.73 0.87 Allowed 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.134 0.573 . . . . 0.0 111.195 179.683 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -158.38 138.42 12.27 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.477 0.711 . . . . 0.0 110.704 -178.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 10.5 p -116.69 139.93 41.36 Favored 'Isoleucine or valine' 0 C--O 1.245 0.824 0 C-N-CA 124.096 0.958 . . . . 0.0 109.213 171.069 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 15.0 m-85 -97.46 86.7 3.93 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 176.733 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.519 ' HG3' ' HA ' ' A' ' 25' ' ' PRO . 8.5 tt0 -91.21 140.98 25.87 Favored Pre-proline 0 CA--C 1.553 1.084 0 N-CA-C 108.358 -0.978 . . . . 0.0 108.358 -173.893 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.519 ' HA ' ' HG3' ' A' ' 24' ' ' GLN . 12.0 Cg_endo -94.09 22.82 28.16 Favored 'Cis proline' 0 C--N 1.387 2.583 0 N-CA-C 116.246 1.595 . . . . 0.0 116.246 7.609 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 35.3 t -68.52 -63.91 0.97 Allowed 'General case' 0 N--CA 1.481 1.08 0 CA-C-N 118.315 0.507 . . . . 0.0 111.572 178.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 124.82 -25.5 5.84 Favored Glycine 0 C--N 1.35 1.312 0 CA-C-O 119.323 -0.71 . . . . 0.0 113.17 -177.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.409 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 10.0 m170 -56.15 140.01 45.59 Favored 'General case' 0 N--CA 1.49 1.574 0 CA-C-N 117.25 0.525 . . . . 0.0 110.498 173.87 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.47 ' HB3' HG22 ' A' ' 19' ' ' ILE . 61.2 mttp -133.99 151.42 51.45 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.905 0.882 . . . . 0.0 110.634 -173.429 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.437 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 89.1 p -164.51 -173.86 3.22 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.82 1.248 . . . . 0.0 107.842 173.606 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 20.0 p -79.12 149.99 31.89 Favored 'General case' 0 C--O 1.244 0.766 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 173.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 63.2 pttt -65.6 -18.1 65.07 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.161 0.584 . . . . 0.0 112.169 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -62.13 -40.75 96.98 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 123.318 0.647 . . . . 0.0 111.332 172.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.8 m -59.52 -52.8 64.01 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.618 0.767 . . . . 0.0 111.174 179.273 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.517 HG21 HG11 ' A' ' 55' ' ' VAL . 9.3 tp -73.18 -32.89 40.15 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.708 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.99 -174.41 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -61.47 -44.95 96.19 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-O 121.014 0.435 . . . . 0.0 109.986 177.567 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -60.15 -40.29 89.36 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 114.784 -1.098 . . . . 0.0 110.974 173.693 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 73.0 t60 -73.85 -33.15 63.99 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 114.759 -1.109 . . . . 0.0 111.698 -174.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 78.8 mt -71.79 -9.13 57.86 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 123.521 0.729 . . . . 0.0 112.102 -176.522 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 17.5 mmt -74.72 -24.6 58.76 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 123.18 0.592 . . . . 0.0 109.747 172.274 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 39.2 t30 -111.34 -73.13 0.69 Allowed 'General case' 0 CA--C 1.555 1.141 0 C-N-CA 124.532 1.133 . . . . 0.0 110.344 -178.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -120.71 -175.17 2.97 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 123.976 0.91 . . . . 0.0 111.15 -175.434 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt -136.63 20.25 3.1 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 123.831 0.852 . . . . 0.0 109.6 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -85.85 164.13 17.7 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 121.291 0.567 . . . . 0.0 110.868 -177.789 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.409 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 53.5 t -91.39 38.65 0.98 Allowed 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.067 0.947 . . . . 0.0 111.97 -173.165 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 57.43 -84.66 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 125.756 1.622 . . . . 0.0 112.627 171.416 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 -67.64 -50.43 58.02 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.593 1.157 . . . . 0.0 110.644 -169.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 14.7 p -97.63 -7.85 30.17 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.387 -177.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt 59.94 13.19 3.51 Favored 'General case' 0 CA--C 1.57 1.744 0 C-N-CA 125.506 1.522 . . . . 0.0 114.299 177.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 55.7 m -64.32 134.17 54.13 Favored 'General case' 0 N--CA 1.479 0.979 0 O-C-N 121.249 -0.907 . . . . 0.0 110.44 176.703 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 25.6 m -63.11 112.54 2.68 Favored 'General case' 0 C--O 1.245 0.868 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 177.75 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.486 HG21 HG22 ' A' ' 55' ' ' VAL . 30.5 mt -69.49 124.02 24.44 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 O-C-N 123.728 0.642 . . . . 0.0 109.825 -174.737 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 89.7 t -71.01 -51.31 36.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 O-C-N 123.705 0.628 . . . . 0.0 109.799 177.15 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 36.2 p -143.34 133.18 23.98 Favored 'General case' 0 C--O 1.249 1.026 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.703 178.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.517 HG11 HG21 ' A' ' 35' ' ' ILE . 23.3 t -102.04 106.97 20.69 Favored 'Isoleucine or valine' 0 C--N 1.348 0.528 0 N-CA-C 107.933 -1.136 . . . . 0.0 107.933 174.355 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -115.7 157.4 24.32 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.63 0.772 . . . . 0.0 110.215 -174.059 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -77.96 128.1 33.39 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 74.7 t90 . . . . . 0 C--O 1.236 0.361 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 175.526 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.598 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 90.2 mt . . . . . 0 N--CA 1.474 0.762 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 50.5 t -57.95 115.05 9.85 Favored Pre-proline 0 CA--C 1.548 0.901 0 O-C-N 123.874 0.734 . . . . 0.0 109.794 178.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_endo -57.45 -18.11 30.22 Favored 'Trans proline' 0 N--CA 1.508 2.335 0 C-N-CA 123.505 2.803 . . . . 0.0 114.034 -172.704 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 56.7 mt -90.29 -42.62 14.22 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.068 0 C-N-CA 123.954 0.902 . . . . 0.0 111.629 178.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 77.7 m -95.24 -53.37 3.81 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 123.114 0.566 . . . . 0.0 110.852 -171.645 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 20.4 t80 80.02 -41.57 0.22 Allowed 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 126.458 1.903 . . . . 0.0 112.617 175.192 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -70.03 -15.1 62.96 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.674 0.79 . . . . 0.0 112.128 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 33.7 m170 -132.1 153.38 81.32 Favored Pre-proline 0 CA--C 1.551 1.017 0 C-N-CA 124.402 1.081 . . . . 0.0 108.588 178.177 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.598 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 60.9 Cg_endo -78.82 -166.23 0.39 Allowed 'Trans proline' 0 C--N 1.379 2.141 0 C-N-CA 123.124 2.549 . . . . 0.0 113.67 -175.238 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.409 HD11 ' HB2' ' A' ' 29' ' ' LYS . 91.3 mt -96.9 146.07 7.99 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.696 0 C-N-CA 124.733 1.213 . . . . 0.0 109.313 174.185 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 28.1 t -141.96 -14.7 0.81 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 123.132 0.573 . . . . 0.0 111.805 176.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -130.95 134.21 46.52 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.135 0.574 . . . . 0.0 110.836 -174.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.488 ' HB ' ' HB2' ' A' ' 58' ' ' TRP . 7.3 p -115.85 140.34 38.14 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 124.041 0.937 . . . . 0.0 110.288 176.227 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -84.71 89.6 7.54 Favored 'General case' 0 C--O 1.242 0.66 0 C-N-CA 124.454 1.101 . . . . 0.0 108.471 175.217 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.406 ' HB3' ' HB3' ' A' ' 54' ' ' SER . 35.7 tt0 -82.18 140.77 45.95 Favored Pre-proline 0 CA--C 1.552 1.034 0 C-N-CA 124.325 1.05 . . . . 0.0 109.988 -177.058 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 14.9 Cg_endo -97.95 31.15 12.26 Favored 'Cis proline' 0 C--N 1.384 2.4 0 CA-C-N 120.226 1.116 . . . . 0.0 114.195 1.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 43.5 t -75.02 -40.91 60.26 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -177.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 85.52 23.64 46.31 Favored Glycine 0 C--N 1.345 1.045 0 C-N-CA 121.619 -0.324 . . . . 0.0 113.655 -176.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.497 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 24.8 m170 -104.59 147.84 27.18 Favored 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 166.812 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.409 ' HB2' HD11 ' A' ' 19' ' ' ILE . 6.3 mptt -132.41 169.47 16.48 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-O 121.602 0.715 . . . . 0.0 112.126 -171.039 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 84.3 p -169.19 -166.43 0.62 Allowed 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.664 1.586 . . . . 0.0 107.594 170.225 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 19.0 p -89.37 154.42 20.08 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 168.248 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.9 -33.99 72.6 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.415 0.686 . . . . 0.0 110.859 -176.551 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -54.88 -40.54 69.85 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.9 0.88 . . . . 0.0 112.52 177.519 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 9.0 m -62.01 -54.56 39.91 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.553 0.741 . . . . 0.0 111.21 178.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 9.5 tp -69.53 -32.55 53.28 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 O-C-N 123.055 0.222 . . . . 0.0 110.739 -175.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 4.6 t30 -58.77 -48.03 82.66 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.643 0.777 . . . . 0.0 110.626 176.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -62.46 -42.18 99.3 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 114.866 -1.061 . . . . 0.0 111.014 176.117 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 52.2 t60 -63.49 -38.52 91.45 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.695 0.798 . . . . 0.0 111.049 -178.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 96.1 mt -69.81 -11.29 60.74 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.809 0.844 . . . . 0.0 112.051 -177.116 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 45.6 mtm -76.48 -15.22 59.95 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 122.821 0.448 . . . . 0.0 111.059 172.545 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 19.3 m-80 -121.09 -64.91 1.19 Allowed 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 124.463 1.105 . . . . 0.0 110.376 -173.726 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 31.1 m-80 -126.81 -174.42 3.13 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 124.842 1.257 . . . . 0.0 109.468 -177.376 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp -137.18 68.89 1.41 Allowed 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 178.063 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.1 m-20 -139.21 165.79 26.24 Favored 'General case' 0 N--CA 1.494 1.726 0 CA-C-O 121.908 0.861 . . . . 0.0 112.076 -168.616 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.497 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 43.7 t -89.67 24.32 2.37 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 125.154 1.382 . . . . 0.0 112.239 -172.03 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 58.93 -86.0 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 125.158 1.383 . . . . 0.0 112.495 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -67.64 -40.39 84.59 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 125.407 1.483 . . . . 0.0 111.382 -162.239 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 7.5 p -108.74 -2.48 18.56 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.181 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 64.5 tttp 66.97 -2.27 1.19 Allowed 'General case' 0 CA--C 1.565 1.526 0 N-CA-C 114.657 1.355 . . . . 0.0 114.657 174.054 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 24.2 m -55.77 124.29 17.02 Favored 'General case' 0 N--CA 1.489 1.523 0 CA-C-N 119.16 0.891 . . . . 0.0 111.112 178.671 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 89.2 m -57.28 134.54 56.05 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.289 0.635 . . . . 0.0 111.674 -178.549 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 48.8 mm -62.38 118.67 4.95 Favored 'Isoleucine or valine' 0 C--N 1.354 0.768 0 C-N-CA 123.511 0.724 . . . . 0.0 110.732 -176.241 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 59.9 t -90.92 -40.33 12.54 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 172.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.406 ' HB3' ' HB3' ' A' ' 24' ' ' GLN . 24.9 t -154.35 146.79 23.98 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.49 0.716 . . . . 0.0 110.148 179.061 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 66.0 t -112.66 103.19 15.05 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 168.59 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -97.25 156.36 16.46 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.528 0.731 . . . . 0.0 109.114 178.046 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -75.65 107.7 7.98 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 170.007 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' TRP . . . . . 0.488 ' HB2' ' HB ' ' A' ' 22' ' ' VAL . 39.3 t90 . . . . . 0 C--O 1.241 0.651 0 O-C-N 123.237 0.336 . . . . 0.0 110.21 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.586 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 92.8 mt . . . . . 0 N--CA 1.47 0.538 0 CA-C-O 120.513 0.197 . . . . 0.0 111.256 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 42.5 t -61.61 119.26 45.66 Favored Pre-proline 0 N--CA 1.475 0.794 0 CA-C-O 118.744 -0.646 . . . . 0.0 110.37 178.223 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -67.0 -11.49 32.46 Favored 'Trans proline' 0 C--N 1.376 2.023 0 C-N-CA 122.746 2.297 . . . . 0.0 113.208 -177.748 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 68.4 mt -97.73 -28.41 3.69 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.153 0 C-N-CA 124.52 1.128 . . . . 0.0 111.886 -176.127 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 71.1 m -115.81 -38.87 3.59 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 122.841 0.456 . . . . 0.0 110.807 -173.188 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 11.0 t80 79.98 -54.77 0.38 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 126.703 2.001 . . . . 0.0 111.802 175.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.5 -38.95 85.99 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 124.084 0.953 . . . . 0.0 112.797 -175.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 65.2 m170 -103.88 153.93 38.42 Favored Pre-proline 0 N--CA 1.486 1.371 0 C-N-CA 123.712 0.805 . . . . 0.0 110.445 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.586 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 97.9 Cg_endo -75.27 -167.83 0.47 Allowed 'Trans proline' 0 C--N 1.38 2.221 0 C-N-CA 123.077 2.518 . . . . 0.0 113.597 -177.361 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.493 HG23 ' HB3' ' A' ' 29' ' ' LYS . 38.8 mt -96.94 147.29 6.41 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 C-N-CA 124.005 0.922 . . . . 0.0 109.938 174.676 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 34.3 p -154.87 25.12 0.44 Allowed 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.995 0.918 . . . . 0.0 110.542 179.141 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -152.56 141.81 21.47 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 124.167 0.987 . . . . 0.0 110.031 178.051 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 6.4 p -137.18 118.99 18.78 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 C-N-CA 124.236 1.014 . . . . 0.0 108.442 176.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -85.02 92.95 8.47 Favored 'General case' 0 C--O 1.244 0.812 0 N-CA-C 108.423 -0.955 . . . . 0.0 108.423 -174.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -83.42 152.62 64.49 Favored Pre-proline 0 CA--C 1.545 0.753 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.498 -178.167 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -89.78 18.12 39.52 Favored 'Cis proline' 0 C--N 1.38 2.223 0 N-CA-C 114.297 0.845 . . . . 0.0 114.297 0.413 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 36.6 t -65.4 -64.59 0.83 Allowed 'General case' 0 C--N 1.356 0.871 0 C-N-CA 123.064 0.545 . . . . 0.0 111.84 -176.549 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 125.67 -19.73 6.58 Favored Glycine 0 C--N 1.345 1.062 0 CA-C-O 118.951 -0.916 . . . . 0.0 113.465 -176.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.448 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 9.4 m170 -61.01 144.41 53.45 Favored 'General case' 0 N--CA 1.487 1.409 0 CA-C-N 117.733 0.766 . . . . 0.0 110.494 176.728 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.493 ' HB3' HG23 ' A' ' 19' ' ' ILE . 58.3 mttp -136.48 157.45 46.75 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 123.876 0.87 . . . . 0.0 110.798 -170.534 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 94.6 p -169.04 179.55 4.0 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.86 1.264 . . . . 0.0 108.556 171.739 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 14.4 p -68.12 142.17 55.86 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 171.343 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.99 -21.65 66.29 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -175.104 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -58.63 -38.47 78.14 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.881 0.873 . . . . 0.0 111.329 173.247 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.8 m -58.59 -55.63 32.53 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 124.07 0.948 . . . . 0.0 111.592 177.359 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.497 HG12 HG21 ' A' ' 55' ' ' VAL . 9.2 tp -73.6 -33.86 40.19 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 O-C-N 123.422 0.451 . . . . 0.0 111.19 -173.269 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -62.96 -41.03 99.41 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-O 120.944 0.402 . . . . 0.0 110.429 175.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -74.88 -28.67 60.74 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 123.685 0.794 . . . . 0.0 110.915 176.707 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 83.2 t60 -69.79 -45.81 67.15 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.841 0.856 . . . . 0.0 110.417 -178.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.453 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 97.4 mt -60.82 -19.08 59.06 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 124.083 0.953 . . . . 0.0 112.656 -176.356 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 84.4 mmm -61.56 -32.59 72.67 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.37 1.068 . . . . 0.0 112.002 173.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 77.3 m-20 -116.4 -58.24 2.11 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.34 0.656 . . . . 0.0 111.134 -176.787 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -122.71 160.66 25.41 Favored 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 124.144 0.977 . . . . 0.0 110.947 -176.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 47.6 mtpt -126.46 63.66 1.27 Allowed 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 174.844 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -128.59 158.12 39.37 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 115.136 -0.938 . . . . 0.0 109.944 -174.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.448 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 42.3 t -87.7 37.37 0.79 Allowed 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 123.675 0.79 . . . . 0.0 111.875 -176.396 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 57.6 -85.3 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 125.697 1.599 . . . . 0.0 112.775 173.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 -74.82 -39.07 61.86 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.639 1.176 . . . . 0.0 111.758 -165.217 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 14.2 p -107.05 -2.53 20.97 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 122.952 0.501 . . . . 0.0 110.994 -179.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 83.8 tttt 66.39 -4.18 0.74 Allowed 'General case' 0 CA--C 1.566 1.582 0 C-N-CA 125.492 1.517 . . . . 0.0 114.917 176.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 22.9 m -51.11 121.16 5.7 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 119.27 0.941 . . . . 0.0 111.128 -177.299 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 20.6 m -51.6 127.84 21.49 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.393 0.677 . . . . 0.0 110.772 -177.077 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.453 HG13 HD11 ' A' ' 35' ' ' ILE . 42.4 mm -60.71 103.28 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.353 0.724 0 O-C-N 123.756 0.66 . . . . 0.0 110.64 -175.542 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 47.4 t -75.76 -55.4 11.5 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 CA-C-N 115.047 -0.979 . . . . 0.0 108.44 174.207 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.8 t -153.57 153.06 31.66 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 123.128 0.571 . . . . 0.0 110.582 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.497 HG21 HG12 ' A' ' 35' ' ' ILE . 58.1 t -127.53 127.13 68.43 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 124.532 1.133 . . . . 0.0 108.462 175.428 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -108.64 143.72 37.34 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.599 0.76 . . . . 0.0 109.055 173.128 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -66.13 106.21 1.58 Allowed 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 108.428 -0.952 . . . . 0.0 108.428 174.313 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 72.1 t90 . . . . . 0 CA--C 1.541 0.613 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 177.209 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.702 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 94.6 mt . . . . . 0 C--O 1.236 0.379 0 CA-C-O 121.283 0.563 . . . . 0.0 111.777 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.404 ' SG ' ' HB ' ' A' ' 13' ' ' ILE . 51.0 t -67.15 114.34 17.97 Favored Pre-proline 0 CA--C 1.545 0.759 0 CA-C-N 114.413 -1.267 . . . . 0.0 109.223 171.583 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -64.0 -8.28 15.66 Favored 'Trans proline' 0 C--N 1.374 1.897 0 C-N-CA 122.814 2.343 . . . . 0.0 113.353 -179.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.404 ' HB ' ' SG ' ' A' ' 11' ' ' CYS . 3.6 mp -84.52 -44.98 17.9 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.989 0 C-N-CA 124.186 0.994 . . . . 0.0 110.172 175.258 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 78.8 m -107.39 -46.87 3.76 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.348 0.659 . . . . 0.0 112.688 -165.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 97.6 m-85 76.81 -39.17 0.33 Allowed 'General case' 0 N--CA 1.499 2.012 0 C-N-CA 126.196 1.798 . . . . 0.0 113.419 178.337 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.75 -20.58 65.25 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.371 0.668 . . . . 0.0 112.797 -177.293 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 80.3 m-70 -134.72 152.74 78.14 Favored Pre-proline 0 C--O 1.248 0.977 0 C-N-CA 123.728 0.811 . . . . 0.0 109.371 -179.14 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.702 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 83.0 Cg_endo -72.66 -166.07 0.26 Allowed 'Trans proline' 0 C--N 1.38 2.224 0 C-N-CA 122.925 2.417 . . . . 0.0 113.822 -178.291 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.555 HG22 ' HB3' ' A' ' 29' ' ' LYS . 92.4 mt -94.64 146.0 7.33 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 C-N-CA 124.469 1.108 . . . . 0.0 108.63 172.922 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 18.9 t -147.33 9.36 0.95 Allowed 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.172 0.589 . . . . 0.0 110.922 178.26 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.417 ' HA ' ' HA ' ' A' ' 57' ' ' ASP . . . -142.29 141.96 32.48 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.173 0.589 . . . . 0.0 110.677 -179.014 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.1 p -119.35 136.99 54.73 Favored 'Isoleucine or valine' 0 C--O 1.245 0.83 0 C-N-CA 124.08 0.952 . . . . 0.0 109.491 177.763 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.416 ' HB3' HG12 ' A' ' 52' ' ' ILE . 10.3 m-30 -98.63 87.44 3.8 Favored 'General case' 0 C--O 1.241 0.644 0 C-N-CA 123.877 0.871 . . . . 0.0 109.057 -177.134 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 17.0 mt-30 -81.9 147.6 58.73 Favored Pre-proline 0 CA--C 1.546 0.803 0 CA-C-N 115.217 -0.901 . . . . 0.0 111.383 -176.403 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.503 ' HD3' ' HB ' ' A' ' 53' ' ' VAL . 43.6 Cg_endo -97.44 24.36 22.42 Favored 'Cis proline' 0 C--N 1.374 1.871 0 C-N-CA 125.322 -0.699 . . . . 0.0 113.384 -0.267 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 37.5 t -71.53 -49.37 41.49 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 122.696 0.398 . . . . 0.0 110.759 -179.102 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 108.79 -12.66 35.12 Favored Glycine 0 C--N 1.348 1.229 0 CA-C-O 119.429 -0.651 . . . . 0.0 114.032 179.119 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.411 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 11.1 m80 -64.53 143.51 57.86 Favored 'General case' 0 N--CA 1.484 1.269 0 CA-C-N 117.391 0.596 . . . . 0.0 110.351 173.487 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.555 ' HB3' HG22 ' A' ' 19' ' ' ILE . 96.2 mttt -135.54 149.6 49.51 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.632 0.773 . . . . 0.0 110.844 -168.831 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 47.2 t -157.64 173.75 16.38 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.253 1.021 . . . . 0.0 109.069 178.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 12.3 p -68.0 146.87 53.13 Favored 'General case' 0 C--O 1.243 0.757 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 176.161 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt -61.78 -28.25 69.32 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.456 0.702 . . . . 0.0 111.777 -174.479 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -62.68 -42.18 99.49 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.765 0.826 . . . . 0.0 111.933 178.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.1 m -56.09 -56.21 23.65 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.315 0.646 . . . . 0.0 111.271 178.408 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.432 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 7.7 tp -73.67 -34.37 41.08 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.75 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.285 -173.767 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -56.85 -46.76 81.56 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 123.294 0.637 . . . . 0.0 110.429 177.054 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -66.41 -40.64 89.71 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.68 176.271 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 82.5 t60 -74.16 -24.28 59.37 Favored 'General case' 0 C--O 1.215 -0.754 0 CA-C-N 115.272 -0.877 . . . . 0.0 112.722 -172.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.432 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 73.2 mt -61.95 -22.41 65.6 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 122.985 0.514 . . . . 0.0 111.976 -179.143 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 24.6 mmt -75.34 -31.14 60.47 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 123.697 0.799 . . . . 0.0 110.643 174.241 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 23.6 m-20 -84.18 -76.33 0.3 Allowed 'General case' 0 CA--C 1.553 1.058 0 C-N-CA 123.937 0.895 . . . . 0.0 109.251 177.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -141.45 -167.23 2.37 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 125.198 1.399 . . . . 0.0 109.641 -176.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -141.98 87.72 2.06 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 173.516 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -152.17 162.42 41.15 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.062 179.564 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.411 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 79.3 m -62.18 142.33 57.7 Favored 'General case' 0 C--N 1.347 0.465 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.206 173.605 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 71.1 m-85 -82.86 26.34 0.6 Allowed 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.379 0.672 . . . . 0.0 110.271 172.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 48.4 m-85 -139.38 -77.2 0.34 Allowed 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 124.21 1.004 . . . . 0.0 108.93 -169.11 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.421 ' SG ' ' OG1' ' A' ' 50' ' ' THR . 1.8 p -95.07 -1.86 51.28 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.178 0.591 . . . . 0.0 111.394 -177.388 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.61 ' HZ2' ' HB2' ' A' ' 49' ' ' LYS . 8.6 mtmp? 63.78 9.54 4.5 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 125.04 1.336 . . . . 0.0 113.928 176.598 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.421 ' OG1' ' SG ' ' A' ' 48' ' ' CYS . 87.4 m -65.6 128.84 37.57 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.236 0.614 . . . . 0.0 111.116 177.351 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 56.9 m -58.16 133.64 55.79 Favored 'General case' 0 C--N 1.352 0.695 0 O-C-N 124.456 1.098 . . . . 0.0 111.512 178.306 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.421 HG21 HG23 ' A' ' 55' ' ' VAL . 30.8 mt -86.6 119.9 35.33 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 C-N-CA 123.907 0.883 . . . . 0.0 109.716 -177.621 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.503 ' HB ' ' HD3' ' A' ' 25' ' ' PRO . 61.1 t -78.91 -35.46 17.86 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.922 0 C-N-CA 123.096 0.558 . . . . 0.0 109.96 178.85 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.7 t -145.91 131.7 19.03 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 122.941 0.496 . . . . 0.0 110.331 175.46 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.421 HG23 HG21 ' A' ' 52' ' ' ILE . 56.6 t -100.48 111.89 31.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 175.771 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -117.71 -178.52 3.5 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 123.095 0.558 . . . . 0.0 110.179 174.544 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . 0.417 ' HA ' ' HA ' ' A' ' 21' ' ' ALA . 35.9 m-20 -100.05 164.37 12.02 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.589 0.756 . . . . 0.0 109.947 178.446 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 54.7 t90 . . . . . 0 N--CA 1.465 0.303 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 179.594 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.597 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 59.6 mt . . . . . 0 C--O 1.236 0.353 0 N-CA-C 110.577 -0.157 . . . . 0.0 110.577 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 46.1 t -50.19 114.78 4.69 Favored Pre-proline 0 CA--C 1.546 0.825 0 O-C-N 124.387 1.054 . . . . 0.0 109.869 179.445 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_exo -57.55 -14.33 16.45 Favored 'Trans proline' 0 C--N 1.38 2.236 0 C-N-CA 123.352 2.701 . . . . 0.0 114.358 -172.778 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.6 mp -89.51 -42.47 14.4 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.253 0 C-N-CA 124.272 1.029 . . . . 0.0 110.047 177.507 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 79.8 m -102.12 -55.03 2.57 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.599 0.76 . . . . 0.0 112.688 -169.04 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.506 ' HA ' ' HB3' ' A' ' 10' ' ' LEU . 96.0 m-85 77.09 -32.29 0.18 Allowed 'General case' 0 N--CA 1.495 1.804 0 C-N-CA 126.318 1.847 . . . . 0.0 113.345 -178.528 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.5 -36.91 79.48 Favored 'General case' 0 N--CA 1.484 1.25 0 CA-C-N 118.564 0.62 . . . . 0.0 111.917 -179.152 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 10.9 m170 -127.07 155.14 76.42 Favored Pre-proline 0 N--CA 1.482 1.145 0 C-N-CA 124.441 1.097 . . . . 0.0 109.139 178.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.597 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 92.6 Cg_endo -76.91 -159.6 0.1 Allowed 'Trans proline' 0 C--N 1.376 2.023 0 C-N-CA 122.707 2.272 . . . . 0.0 113.936 179.379 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.417 HG21 ' HB3' ' A' ' 29' ' ' LYS . 83.0 mt -78.58 138.0 20.95 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.799 0 C-N-CA 124.285 1.034 . . . . 0.0 110.906 177.504 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.2 m -110.8 -27.77 8.71 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.568 0.747 . . . . 0.0 110.731 176.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.436 ' HB1' HG13 ' A' ' 55' ' ' VAL . . . -147.58 154.16 40.34 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.096 0.558 . . . . 0.0 111.778 -166.097 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 5.7 p -123.46 124.81 70.51 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.95 0 C-N-CA 124.552 1.141 . . . . 0.0 109.851 179.311 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -77.41 94.7 4.28 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.12 0.968 . . . . 0.0 108.97 178.55 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 -98.09 155.46 36.98 Favored Pre-proline 0 CA--C 1.546 0.823 0 C-N-CA 123.054 0.542 . . . . 0.0 111.14 -174.603 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -85.72 18.89 27.95 Favored 'Cis proline' 0 C--N 1.383 2.378 0 N-CA-C 115.049 1.134 . . . . 0.0 115.049 3.342 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 53.4 t -67.8 -65.07 0.74 Allowed 'General case' 0 C--N 1.354 0.765 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -177.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 124.93 -16.87 7.25 Favored Glycine 0 C--N 1.35 1.313 0 CA-C-O 119.13 -0.817 . . . . 0.0 114.211 179.5 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.562 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 21.5 m80 -63.94 149.14 47.89 Favored 'General case' 0 N--CA 1.482 1.146 0 CA-C-N 117.644 0.722 . . . . 0.0 110.206 171.987 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.417 ' HB3' HG21 ' A' ' 19' ' ' ILE . 83.1 mttt -137.22 161.58 35.82 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 123.703 0.801 . . . . 0.0 110.77 -168.324 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 38.3 t -172.98 178.65 2.48 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.847 1.259 . . . . 0.0 108.714 178.344 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 13.6 p -79.36 153.11 30.01 Favored 'General case' 0 C--O 1.246 0.9 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 173.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt -67.19 -23.6 65.77 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.289 0.636 . . . . 0.0 111.767 -173.353 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.51 -42.29 92.22 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.744 0.818 . . . . 0.0 111.553 177.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 8.7 m -56.78 -54.5 45.63 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.447 0.699 . . . . 0.0 110.851 176.429 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.501 HG12 HG21 ' A' ' 55' ' ' VAL . 9.8 tp -74.97 -23.36 17.39 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.982 0 O-C-N 123.688 0.617 . . . . 0.0 111.11 -174.67 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -62.56 -55.41 27.49 Favored 'General case' 0 N--CA 1.487 1.414 0 CA-C-O 121.505 0.669 . . . . 0.0 109.868 173.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 61.0 tt0 -70.44 -19.55 62.96 Favored 'General case' 0 CA--C 1.553 1.06 0 CA-C-N 114.519 -1.219 . . . . 0.0 111.063 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 62.7 t60 -81.51 -41.74 21.25 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.347 0.659 . . . . 0.0 111.367 178.685 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 48.9 mt -66.85 -24.49 66.15 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.122 0.569 . . . . 0.0 112.527 -173.445 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 27.3 ptm -69.99 -21.21 63.25 Favored 'General case' 0 N--CA 1.482 1.174 0 CA-C-O 120.576 0.226 . . . . 0.0 110.957 175.315 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 66.0 m-20 -106.02 -73.86 0.67 Allowed 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.882 0.873 . . . . 0.0 109.749 -179.041 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -111.68 -174.57 2.49 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 124.545 1.138 . . . . 0.0 110.491 -176.736 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 22.1 ttmm -139.82 15.64 2.49 Favored 'General case' 0 N--CA 1.486 1.33 0 CA-C-O 121.484 0.659 . . . . 0.0 110.665 179.63 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -88.86 164.17 15.31 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-O 121.326 0.584 . . . . 0.0 111.408 -174.469 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.562 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 43.5 t -91.66 32.87 1.05 Allowed 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 124.526 1.13 . . . . 0.0 112.664 -172.427 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 57.7 -83.46 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 125.231 1.413 . . . . 0.0 112.646 174.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -67.55 -24.96 65.59 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 125.505 1.522 . . . . 0.0 112.735 -167.022 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.429 ' SG ' ' OG1' ' A' ' 50' ' ' THR . 15.2 p -131.03 -7.48 3.9 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 122.93 0.492 . . . . 0.0 111.195 -176.784 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 55.2 tttm 64.48 11.91 6.96 Favored 'General case' 0 CA--C 1.569 1.691 0 C-N-CA 124.784 1.234 . . . . 0.0 113.548 177.002 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.429 ' OG1' ' SG ' ' A' ' 48' ' ' CYS . 26.7 m -62.86 133.7 55.1 Favored 'General case' 0 N--CA 1.481 1.088 0 O-C-N 121.407 -0.808 . . . . 0.0 110.451 176.412 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 23.8 m -60.79 119.84 8.96 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.112 0.565 . . . . 0.0 110.323 179.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.448 HG23 HG23 ' A' ' 55' ' ' VAL . 46.6 mt -79.54 122.2 34.29 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 O-C-N 123.454 0.471 . . . . 0.0 109.754 -179.68 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 46.2 t -81.53 -38.53 16.3 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 C-N-CA 123.208 0.603 . . . . 0.0 109.553 175.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 34.2 p -168.11 136.97 2.41 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.706 0.803 . . . . 0.0 110.713 175.615 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.501 HG21 HG12 ' A' ' 35' ' ' ILE . 21.7 t -96.72 113.56 31.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 123.87 0.868 . . . . 0.0 109.254 178.064 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.1 mm-40 -85.24 172.86 10.82 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 110.073 -0.343 . . . . 0.0 110.073 175.313 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -87.52 135.56 33.3 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 174.212 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 73.4 t90 . . . . . 0 N--CA 1.477 0.906 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 175.698 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.584 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 93.3 mt . . . . . 0 N--CA 1.479 1.023 0 N-CA-C 110.617 -0.142 . . . . 0.0 110.617 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.461 ' HB3' ' HB2' ' A' ' 14' ' ' CYS . 42.4 t -66.74 116.42 34.77 Favored Pre-proline 0 CA--C 1.552 1.041 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 175.468 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_endo -58.23 -17.28 31.78 Favored 'Trans proline' 0 C--N 1.382 2.321 0 C-N-CA 123.417 2.745 . . . . 0.0 114.119 -174.683 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 73.3 mt -88.17 -45.88 15.81 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.885 0 C-N-CA 123.882 0.873 . . . . 0.0 110.788 176.544 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.461 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . 86.3 m -90.76 -55.58 3.51 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.126 0.57 . . . . 0.0 111.73 -167.861 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 84.3 m-85 74.84 -43.32 0.52 Allowed 'General case' 0 N--CA 1.494 1.743 0 C-N-CA 126.285 1.834 . . . . 0.0 111.872 -174.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.3 -30.6 71.26 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 124.004 0.921 . . . . 0.0 112.372 -178.752 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 21.7 m-70 -124.4 151.23 66.35 Favored Pre-proline 0 N--CA 1.479 1.016 0 C-N-CA 124.047 0.939 . . . . 0.0 109.521 176.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.584 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 13.1 Cg_exo -71.36 -164.55 0.16 Allowed 'Trans proline' 0 C--N 1.381 2.259 0 C-N-CA 123.898 3.066 . . . . 0.0 114.086 -177.075 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 83.2 mt -86.51 129.93 37.52 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.84 0 C-N-CA 123.466 0.706 . . . . 0.0 110.065 175.726 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 25.8 t -132.46 6.44 4.11 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 123.876 0.87 . . . . 0.0 110.875 178.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -154.95 160.93 41.48 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-O 121.343 0.592 . . . . 0.0 111.413 -178.279 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 4.7 p -145.71 139.76 21.52 Favored 'Isoleucine or valine' 0 C--O 1.244 0.781 0 C-N-CA 124.863 1.265 . . . . 0.0 108.752 177.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -96.79 88.11 4.5 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 178.125 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 16.1 mt-30 -84.95 149.41 53.24 Favored Pre-proline 0 C--O 1.242 0.704 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.359 -176.407 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -92.29 22.38 29.34 Favored 'Cis proline' 0 C--N 1.383 2.368 0 N-CA-C 114.776 1.029 . . . . 0.0 114.776 2.209 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 35.3 t -69.13 -50.12 50.85 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 122.767 0.427 . . . . 0.0 111.555 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 105.58 -6.08 41.23 Favored Glycine 0 C--N 1.343 0.96 0 CA-C-O 118.967 -0.907 . . . . 0.0 114.619 177.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.431 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 3.8 m170 -62.99 128.14 34.47 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 117.662 0.731 . . . . 0.0 110.016 173.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -101.21 156.82 17.21 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.219 1.008 . . . . 0.0 110.897 -174.049 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 79.9 p -168.72 -157.34 0.19 Allowed 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.415 1.086 . . . . 0.0 108.257 175.176 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 30.8 p -116.44 161.19 19.46 Favored 'General case' 0 C--O 1.247 0.964 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 170.179 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 57.5 mtpt -57.07 -40.17 76.39 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 123.494 0.718 . . . . 0.0 111.12 -179.295 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -53.83 -42.13 68.12 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 123.918 0.887 . . . . 0.0 113.086 179.197 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 8.7 m -60.32 -56.63 19.1 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.653 0.781 . . . . 0.0 111.274 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.403 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 8.6 tp -72.92 -35.36 48.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.519 -171.901 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -61.29 -47.45 85.91 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.207 0.603 . . . . 0.0 111.279 177.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 37.0 tt0 -62.94 -34.38 77.35 Favored 'General case' 0 CA--C 1.554 1.102 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.657 176.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 84.8 t60 -73.56 -37.51 65.52 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.274 1.03 . . . . 0.0 112.477 -178.334 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 77.8 mt -64.6 -17.56 64.11 Favored 'General case' 0 N--CA 1.492 1.644 0 C-N-CA 123.505 0.722 . . . . 0.0 112.569 -174.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 87.1 mtp -66.86 -29.16 68.99 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.297 0.639 . . . . 0.0 111.021 174.271 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 31.5 t30 -105.15 -72.89 0.69 Allowed 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 123.91 0.884 . . . . 0.0 110.269 177.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 79.3 m-20 -115.98 164.61 14.17 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.45 0.7 . . . . 0.0 110.783 -173.873 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -124.51 45.65 2.47 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.065 0.946 . . . . 0.0 108.93 176.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -109.18 168.65 9.22 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.498 177.547 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.431 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 41.6 t -93.61 32.5 1.39 Allowed 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 124.668 1.187 . . . . 0.0 111.922 -171.414 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 59.4 -84.35 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 125.616 1.566 . . . . 0.0 112.287 175.817 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 16.4 m-85 -70.6 -32.98 70.54 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.879 1.272 . . . . 0.0 112.05 -164.606 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 14.8 p -119.53 -6.2 10.24 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 122.926 0.49 . . . . 0.0 111.161 -178.109 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 55.4 mtpt 60.28 18.69 8.21 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 114.82 1.415 . . . . 0.0 114.82 178.559 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 45.6 m -62.9 137.1 58.18 Favored 'General case' 0 N--CA 1.48 1.053 0 CA-C-N 118.173 0.442 . . . . 0.0 109.936 174.081 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 29.0 m -58.15 129.64 42.93 Favored 'General case' 0 C--O 1.246 0.9 0 C-N-CA 123.24 0.616 . . . . 0.0 110.331 177.69 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 41.9 mm -66.64 102.01 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.814 0 O-C-N 123.724 0.64 . . . . 0.0 109.724 179.046 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 97.7 t -73.16 -37.69 53.17 Favored 'Isoleucine or valine' 0 C--O 1.242 0.687 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 172.071 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.8 p -158.57 133.21 8.17 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.455 174.521 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 48.5 t -90.37 116.99 32.75 Favored 'Isoleucine or valine' 0 C--N 1.353 0.73 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 163.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -122.63 135.55 54.64 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 177.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -60.92 159.16 11.81 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.665 0.786 . . . . 0.0 110.201 173.344 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 37.3 t90 . . . . . 0 CA--C 1.538 0.483 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 -177.138 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.532 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 74.4 mt . . . . . 0 N--CA 1.476 0.867 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 52.5 t -57.2 114.93 9.09 Favored Pre-proline 0 CA--C 1.55 0.952 0 O-C-N 124.308 1.005 . . . . 0.0 108.868 174.143 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -57.35 -19.84 37.13 Favored 'Trans proline' 0 N--CA 1.508 2.361 0 C-N-CA 123.373 2.716 . . . . 0.0 114.185 -175.172 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.8 mp -80.02 -26.76 12.04 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.468 0 C-N-CA 124.269 1.028 . . . . 0.0 110.774 -176.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 40.4 m -133.33 -42.06 0.87 Allowed 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 113.256 0.836 . . . . 0.0 113.256 -161.162 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 93.1 m-85 77.94 -37.64 0.24 Allowed 'General case' 0 N--CA 1.496 1.846 0 C-N-CA 126.248 1.819 . . . . 0.0 113.108 178.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -74.59 -6.95 51.44 Favored 'General case' 0 CA--C 1.555 1.156 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 -169.032 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 66.9 m-70 -141.49 137.72 16.74 Favored Pre-proline 0 N--CA 1.494 1.734 0 CA-C-N 118.658 0.663 . . . . 0.0 109.936 174.634 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.532 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 47.2 Cg_endo -88.62 80.69 0.94 Allowed 'Trans proline' 0 C--N 1.383 2.355 0 C-N-CA 123.429 2.753 . . . . 0.0 114.027 -178.725 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 64.7 mt 63.07 155.5 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.037 0 C-N-CA 124.948 1.299 . . . . 0.0 111.957 -178.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 26.3 t -159.81 -7.6 0.06 Allowed 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 122.696 0.398 . . . . 0.0 111.766 173.126 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -152.03 132.52 13.83 Favored 'General case' 0 N--CA 1.481 1.083 0 CA-C-N 118.348 0.522 . . . . 0.0 111.144 -175.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.2 p -102.41 132.89 47.53 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.88 0 C-N-CA 124.231 1.013 . . . . 0.0 109.834 173.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -93.71 100.11 12.39 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.118 -178.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 -90.02 151.47 45.14 Favored Pre-proline 0 CA--C 1.545 0.759 0 C-N-CA 123.61 0.764 . . . . 0.0 110.92 178.07 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_endo -92.44 32.21 10.7 Favored 'Cis proline' 0 C--N 1.376 2.011 0 CA-C-N 118.528 0.51 . . . . 0.0 113.112 3.436 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.7 t -83.49 -72.83 0.44 Allowed 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 122.67 0.388 . . . . 0.0 111.246 -179.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 133.67 -30.4 2.99 Favored Glycine 0 C--N 1.349 1.254 0 CA-C-O 119.696 -0.502 . . . . 0.0 112.674 -176.028 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 20.1 m170 -57.29 132.3 52.62 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 123.385 0.674 . . . . 0.0 110.717 175.536 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 50.3 mttp -115.52 150.66 36.2 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.152 0.981 . . . . 0.0 110.44 -175.847 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 54.5 p -142.13 -155.94 0.64 Allowed 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 166.168 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 22.3 p -99.41 162.09 13.24 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 118.312 0.506 . . . . 0.0 109.79 173.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -63.58 -34.6 78.18 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.029 0.932 . . . . 0.0 111.282 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.87 -32.51 70.78 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.42 0.688 . . . . 0.0 111.584 176.761 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.4 m -63.52 -55.39 24.35 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.507 0.723 . . . . 0.0 111.07 176.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.622 HG12 HG23 ' A' ' 55' ' ' VAL . 8.8 tp -69.75 -37.74 74.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 O-C-N 123.579 0.549 . . . . 0.0 110.95 -173.491 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -63.47 -38.44 91.15 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-O 121.134 0.492 . . . . 0.0 110.683 178.561 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -73.18 -32.69 64.98 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 123.538 0.735 . . . . 0.0 110.675 175.423 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 59.8 t60 -72.94 -32.5 65.32 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.86 0.864 . . . . 0.0 110.713 -176.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 97.4 mt -72.39 -7.42 49.6 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.864 0.866 . . . . 0.0 111.9 -179.072 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 92.9 mmm -74.31 -14.11 60.85 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 123.657 0.783 . . . . 0.0 110.851 168.315 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 19.1 t30 -131.37 -73.17 0.53 Allowed 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 124.131 0.972 . . . . 0.0 111.064 -175.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -126.79 -170.07 2.14 Favored 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 123.695 0.798 . . . . 0.0 111.177 -176.152 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -145.34 35.36 1.08 Allowed 'General case' 0 N--CA 1.476 0.825 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 176.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.507 ' HA ' ' HA ' ' A' ' 51' ' ' THR . 4.5 m-20 -99.16 156.82 16.76 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.144 -177.16 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.427 ' HB2' ' O ' ' A' ' 50' ' ' THR . 5.4 t -72.01 115.66 11.5 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 86.9 m-85 -49.42 -34.66 17.02 Favored 'General case' 0 N--CA 1.495 1.823 0 C-N-CA 123.989 0.916 . . . . 0.0 112.866 -177.175 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 77.6 m-85 -91.7 -28.04 17.69 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 115.2 -0.909 . . . . 0.0 112.777 -169.617 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 7.8 p -149.61 22.72 0.9 Allowed 'General case' 0 N--CA 1.496 1.857 0 N-CA-C 113.316 0.858 . . . . 0.0 113.316 -169.155 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 65.7 mttm 71.24 -28.22 0.18 Allowed 'General case' 0 N--CA 1.505 2.277 0 N-CA-C 115.671 1.73 . . . . 0.0 115.671 172.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.427 ' O ' ' HB2' ' A' ' 45' ' ' CYS . 7.7 m -57.43 114.25 2.13 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.75 0.82 . . . . 0.0 112.268 -169.483 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.507 ' HA ' ' HA ' ' A' ' 44' ' ' ASP . 24.8 m -57.48 123.67 16.3 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 123.369 0.668 . . . . 0.0 110.508 -179.63 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.508 HG21 HG22 ' A' ' 55' ' ' VAL . 12.2 mt -71.97 122.57 24.59 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 124.86 1.264 . . . . 0.0 109.515 -175.75 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 83.9 t -81.39 -34.31 13.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 C-N-CA 122.968 0.507 . . . . 0.0 109.842 178.43 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 24.5 t -156.29 135.7 12.28 Favored 'General case' 0 C--N 1.355 0.828 0 CA-C-O 120.935 0.397 . . . . 0.0 110.596 -179.058 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.622 HG23 HG12 ' A' ' 35' ' ' ILE . 31.6 t -108.83 106.78 21.35 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 123.682 0.793 . . . . 0.0 109.881 179.871 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -93.39 141.92 27.91 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 173.45 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -79.24 118.56 21.29 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 173.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 74.1 t90 . . . . . 0 C--O 1.238 0.451 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 -175.551 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.63 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 88.0 mt . . . . . 0 CA--C 1.536 0.428 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.599 ' SG ' ' HB2' ' A' ' 30' ' ' SER . 45.2 t -59.3 118.26 28.98 Favored Pre-proline 0 CA--C 1.548 0.899 0 CA-C-O 118.357 -0.83 . . . . 0.0 108.901 173.251 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_endo -60.55 -17.37 48.18 Favored 'Trans proline' 0 N--CA 1.507 2.3 0 C-N-CA 123.111 2.54 . . . . 0.0 112.848 -176.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 67.8 mt -86.53 -46.2 16.55 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.871 0 C-N-CA 124.925 1.29 . . . . 0.0 111.628 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 91.9 m -92.66 -38.39 11.88 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.253 0.621 . . . . 0.0 111.564 -170.357 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.423 ' O ' HD12 ' A' ' 10' ' ' LEU . 98.1 m-85 74.69 -44.64 0.56 Allowed 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 126.232 1.813 . . . . 0.0 112.976 179.56 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -76.76 -32.49 57.76 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.268 0.627 . . . . 0.0 112.667 -175.517 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 15.6 m-70 -112.64 153.28 45.06 Favored Pre-proline 0 N--CA 1.481 1.1 0 C-N-CA 123.875 0.87 . . . . 0.0 109.52 -175.475 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.63 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 64.6 Cg_endo -79.05 -170.89 1.1 Allowed 'Trans proline' 0 C--N 1.38 2.213 0 C-N-CA 123.124 2.549 . . . . 0.0 113.9 -174.395 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.456 HG21 ' HB3' ' A' ' 29' ' ' LYS . 97.4 mt -89.99 143.18 11.72 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 CA-C-N 114.792 -1.094 . . . . 0.0 109.968 176.841 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.6 m -142.29 13.42 2.0 Allowed 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.079 0.952 . . . . 0.0 110.841 179.698 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -155.78 136.26 13.24 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.711 0.805 . . . . 0.0 110.928 -175.588 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.7 p -122.02 126.99 75.2 Favored 'Isoleucine or valine' 0 C--O 1.24 0.564 0 C-N-CA 124.605 1.162 . . . . 0.0 108.45 172.329 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -92.98 88.65 6.22 Favored 'General case' 0 C--O 1.244 0.789 0 N-CA-C 108.133 -1.062 . . . . 0.0 108.133 -178.281 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -71.56 152.35 93.77 Favored Pre-proline 0 C--O 1.242 0.704 0 CA-C-N 114.035 -1.438 . . . . 0.0 111.863 -177.506 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_endo -92.48 28.9 15.83 Favored 'Cis proline' 0 C--N 1.375 1.955 0 C-N-CA 125.783 -0.507 . . . . 0.0 112.616 -9.43 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 53.6 t -77.24 -40.31 45.33 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.258 0.623 . . . . 0.0 111.551 -176.022 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 91.73 -6.34 79.79 Favored Glycine 0 C--N 1.343 0.942 0 CA-C-O 119.37 -0.683 . . . . 0.0 114.369 179.168 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.496 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 13.5 m170 -64.95 135.51 55.75 Favored 'General case' 0 N--CA 1.481 1.084 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 167.127 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.456 ' HB3' HG21 ' A' ' 19' ' ' ILE . 86.5 mttt -136.09 151.24 49.61 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.391 0.676 . . . . 0.0 110.644 -171.126 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.599 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 92.7 p -161.9 -173.93 3.92 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.486 1.114 . . . . 0.0 108.389 172.272 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 15.8 p -75.06 145.95 41.92 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 174.308 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -67.56 -19.81 65.32 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 122.951 0.5 . . . . 0.0 111.957 -173.456 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.78 -39.53 85.21 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 123.744 0.818 . . . . 0.0 111.536 171.408 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.8 m -61.74 -49.02 78.08 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.608 0.763 . . . . 0.0 111.721 178.364 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.502 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 9.7 tp -72.14 -36.68 57.24 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 O-C-N 123.116 0.26 . . . . 0.0 111.101 -173.36 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -64.11 -38.66 91.87 Favored 'General case' 0 CA--C 1.549 0.937 0 CA-C-O 121.126 0.488 . . . . 0.0 109.843 177.611 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.493 ' O ' ' HG2' ' A' ' 40' ' ' MET . 45.9 tt0 -69.75 -27.98 65.4 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 123.961 0.905 . . . . 0.0 110.767 173.661 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 78.3 t60 -83.59 -26.57 29.9 Favored 'General case' 0 C--O 1.21 -1.007 0 C-N-CA 123.281 0.632 . . . . 0.0 111.292 -177.303 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.566 HD21 ' HG3' ' A' ' 43' ' ' LYS . 88.0 mt -69.01 -30.77 69.24 Favored 'General case' 0 N--CA 1.486 1.338 0 CA-C-N 118.314 0.506 . . . . 0.0 111.328 -177.479 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.493 ' HG2' ' O ' ' A' ' 37' ' ' GLN . 25.1 ptt? -68.28 -21.03 64.81 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 122.402 0.281 . . . . 0.0 110.53 173.871 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.425 ' ND2' HD21 ' A' ' 42' ' ' ASN . 6.6 t30 -88.3 -75.81 0.41 Allowed 'General case' 0 CA--C 1.558 1.279 0 C-N-CA 124.435 1.094 . . . . 0.0 109.412 175.34 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.425 HD21 ' ND2' ' A' ' 41' ' ' ASN . 48.4 m-80 -148.35 151.56 35.55 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 124.778 1.231 . . . . 0.0 109.673 178.162 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.566 ' HG3' HD21 ' A' ' 39' ' ' LEU . 13.5 mptt -90.63 62.04 5.03 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.592 0.757 . . . . 0.0 110.176 179.709 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -130.16 174.49 9.76 Favored 'General case' 0 N--CA 1.481 1.102 0 CA-C-O 121.423 0.63 . . . . 0.0 110.953 179.221 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.496 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 41.8 t -98.49 45.87 1.01 Allowed 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.63 1.172 . . . . 0.0 110.86 -172.45 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 57.39 -87.31 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 125.651 1.58 . . . . 0.0 113.031 172.092 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 73.0 m-85 -75.27 -37.34 60.97 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.923 1.289 . . . . 0.0 111.572 -165.288 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.426 ' SG ' ' OG1' ' A' ' 50' ' ' THR . 13.8 p -110.12 -9.43 14.71 Favored 'General case' 0 N--CA 1.482 1.153 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.432 -172.372 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 99.0 mttt 60.57 30.55 19.83 Favored 'General case' 0 N--CA 1.492 1.626 0 C-N-CA 124.502 1.121 . . . . 0.0 113.74 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.426 ' OG1' ' SG ' ' A' ' 48' ' ' CYS . 74.4 m -65.97 127.64 32.89 Favored 'General case' 0 N--CA 1.481 1.117 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 169.358 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 9.0 m -59.57 123.19 16.07 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 109.611 -0.515 . . . . 0.0 109.611 176.79 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 36.4 mm -59.51 105.7 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.929 0 O-C-N 123.757 0.661 . . . . 0.0 110.725 -176.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 35.4 t -79.28 -46.08 23.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 175.474 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 30.0 p -160.24 138.78 10.31 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.171 0.588 . . . . 0.0 111.071 176.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.476 HG13 HG23 ' A' ' 35' ' ' ILE . 65.4 t -106.66 108.5 25.31 Favored 'Isoleucine or valine' 0 C--O 1.243 0.722 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 170.564 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -104.12 147.38 27.49 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 123.322 0.649 . . . . 0.0 109.798 178.657 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -69.46 96.8 0.93 Allowed 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 178.043 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 63.4 t90 . . . . . 0 CA--C 1.543 0.701 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 -178.894 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 77.9 p . . . . . 0 N--CA 1.475 0.779 0 CA-C-O 120.685 0.279 . . . . 0.0 110.841 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 8.3 p80 -136.6 99.58 4.11 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 172.255 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 83.5 mtp -123.58 120.85 26.82 Favored Pre-proline 0 N--CA 1.482 1.169 0 C-N-CA 123.263 0.625 . . . . 0.0 109.703 -176.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -75.36 -31.37 5.82 Favored 'Trans proline' 0 C--N 1.38 2.233 0 C-N-CA 122.485 2.123 . . . . 0.0 111.691 174.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 49.3 p -86.29 103.52 14.97 Favored 'General case' 0 C--O 1.24 0.559 0 C-N-CA 124.127 0.971 . . . . 0.0 109.61 179.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.424 ' OG ' ' HB2' ' A' ' 10' ' ' LEU . 37.1 t -101.66 155.02 18.36 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.084 0.954 . . . . 0.0 110.335 -178.506 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -65.53 -34.0 77.24 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.56 0.744 . . . . 0.0 110.957 -178.478 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -137.6 -156.58 0.7 Allowed 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 124.43 1.092 . . . . 0.0 108.18 176.214 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -81.5 43.34 0.73 Allowed 'General case' 0 N--CA 1.484 1.238 0 CA-C-O 121.568 0.699 . . . . 0.0 110.329 171.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.699 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 93.8 mt -66.71 125.86 27.16 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.903 -173.539 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.51 ' SG ' ' HB2' ' A' ' 30' ' ' SER . 42.0 t -49.71 111.62 2.16 Favored Pre-proline 0 CA--C 1.547 0.862 0 C-N-CA 124.753 1.221 . . . . 0.0 110.211 179.589 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -62.44 -21.41 72.72 Favored 'Trans proline' 0 C--N 1.378 2.089 0 C-N-CA 123.22 2.614 . . . . 0.0 113.661 -171.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 64.9 mt -68.41 -27.54 37.07 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.153 0 C-N-CA 124.064 0.946 . . . . 0.0 111.411 176.573 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 64.6 m -125.75 -32.85 2.8 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 -164.215 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 68.03 -47.02 0.52 Allowed 'General case' 0 N--CA 1.495 1.799 0 C-N-CA 125.807 1.643 . . . . 0.0 114.068 -173.006 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -66.52 -37.76 85.73 Favored 'General case' 0 CA--C 1.55 0.946 0 N-CA-C 113.677 0.991 . . . . 0.0 113.677 -168.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 20.8 m-70 -118.77 150.88 49.25 Favored Pre-proline 0 N--CA 1.491 1.6 0 C-N-CA 123.58 0.752 . . . . 0.0 109.85 -176.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.699 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 43.9 Cg_endo -84.26 -173.35 1.51 Allowed 'Trans proline' 0 C--N 1.379 2.134 0 C-N-CA 123.042 2.495 . . . . 0.0 113.42 -178.116 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 82.8 mt -80.31 142.54 13.76 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.794 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.349 176.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.483 ' HB3' ' HG3' ' A' ' 32' ' ' LYS . 23.1 t -150.17 -4.01 0.36 Allowed 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 123.236 0.614 . . . . 0.0 111.692 177.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -137.64 132.4 32.93 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.017 0.527 . . . . 0.0 110.725 -175.104 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 12.9 p -106.05 145.85 13.47 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 C-N-CA 124.621 1.168 . . . . 0.0 109.6 174.029 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 19.7 m-85 -112.59 88.27 2.78 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.694 0.798 . . . . 0.0 109.496 -175.304 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 51.0 mt-30 -75.82 155.83 84.81 Favored Pre-proline 0 C--O 1.243 0.737 0 C-N-CA 124.078 0.951 . . . . 0.0 111.824 -176.531 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -82.32 2.21 50.62 Favored 'Cis proline' 0 N--CA 1.508 2.333 0 N-CA-C 114.585 0.956 . . . . 0.0 114.585 -2.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 41.5 t -64.44 -49.65 70.62 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.303 0.641 . . . . 0.0 112.308 -177.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 101.65 -3.1 53.14 Favored Glycine 0 CA--C 1.529 0.955 0 CA-C-O 118.47 -1.183 . . . . 0.0 114.691 178.196 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.596 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 4.4 m170 -62.74 145.04 55.75 Favored 'General case' 0 N--CA 1.492 1.67 0 CA-C-N 118.493 1.146 . . . . 0.0 110.01 175.569 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 50.8 mttp -133.34 147.91 51.85 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 122.738 0.415 . . . . 0.0 111.254 -169.254 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.51 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 88.1 p -161.19 -169.7 2.42 Favored 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 124.105 0.962 . . . . 0.0 108.971 174.045 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 17.7 p -74.42 151.96 39.56 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 122.561 0.345 . . . . 0.0 110.372 177.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.483 ' HG3' ' HB3' ' A' ' 20' ' ' SER . 28.0 mtpp -58.69 -37.77 76.8 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.141 0.576 . . . . 0.0 111.439 179.057 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -58.3 -28.64 65.2 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.51 0.724 . . . . 0.0 112.68 178.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.2 m -59.54 -62.15 2.09 Favored 'General case' 0 N--CA 1.483 1.18 0 O-C-N 123.747 0.655 . . . . 0.0 110.89 177.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.623 HG12 HG21 ' A' ' 55' ' ' VAL . 7.3 tp -66.76 -41.06 87.38 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 O-C-N 123.8 0.688 . . . . 0.0 111.447 -172.371 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -58.53 -43.65 89.3 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 122.808 0.443 . . . . 0.0 110.816 179.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -71.77 -34.84 69.8 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.39 0.676 . . . . 0.0 109.893 176.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 74.9 t60 -70.98 -28.57 64.54 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.288 1.035 . . . . 0.0 111.097 -176.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.423 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 94.7 mt -70.61 -11.25 60.82 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.426 0.69 . . . . 0.0 111.632 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 30.8 mmt -82.15 -14.27 55.94 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.941 0.896 . . . . 0.0 110.931 172.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 -116.09 -74.19 0.62 Allowed 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.699 1.2 . . . . 0.0 109.783 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 79.0 m-20 -125.28 -168.09 1.78 Allowed 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 124.528 1.131 . . . . 0.0 110.9 -176.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -134.66 24.59 3.7 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 124.312 1.045 . . . . 0.0 109.512 171.291 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -87.57 165.1 15.71 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-O 121.326 0.584 . . . . 0.0 111.85 -175.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.596 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 43.5 t -94.19 36.15 1.15 Allowed 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.813 1.245 . . . . 0.0 112.086 -169.557 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 54.16 -82.39 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 125.429 1.492 . . . . 0.0 113.197 169.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 41.6 m-85 -70.71 -11.99 61.28 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.119 1.368 . . . . 0.0 113.071 -169.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 15.3 p -143.14 -7.13 0.81 Allowed 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 122.87 0.468 . . . . 0.0 111.638 178.395 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 52.1 tttm 63.03 22.79 13.65 Favored 'General case' 0 CA--C 1.569 1.676 0 C-N-CA 124.496 1.118 . . . . 0.0 113.124 176.292 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 56.0 m -73.13 151.84 41.42 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.216 0.607 . . . . 0.0 110.625 174.173 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 56.6 m -63.43 120.5 11.77 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 122.605 0.362 . . . . 0.0 110.373 174.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.436 HG21 HG23 ' A' ' 55' ' ' VAL . 49.5 mt -79.9 111.38 16.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 172.681 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 87.2 t -75.57 -46.04 37.89 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 O-C-N 123.452 0.47 . . . . 0.0 109.75 176.587 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.5 m -141.91 134.4 28.16 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 122.828 0.451 . . . . 0.0 110.677 -179.268 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.623 HG21 HG12 ' A' ' 35' ' ' ILE . 41.6 t -102.3 104.12 16.01 Favored 'Isoleucine or valine' 0 C--O 1.244 0.781 0 C-N-CA 123.776 0.831 . . . . 0.0 108.888 172.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 52.8 mm-40 -105.0 156.78 17.72 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 109.843 -0.429 . . . . 0.0 109.843 179.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -78.79 108.11 11.99 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.319 175.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 53.2 t90 -74.93 112.02 10.73 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 175.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -79.29 131.15 36.06 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 174.321 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 16.5 ptpt -95.31 6.33 49.31 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.175 0.59 . . . . 0.0 111.183 178.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.315 0 CA-C-O 118.906 -0.941 . . . . 0.0 112.063 176.884 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 28.6 p . . . . . 0 N--CA 1.479 0.976 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 55.9 t-80 -95.35 126.69 40.83 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.273 0.629 . . . . 0.0 109.937 -179.239 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.403 ' SD ' ' N ' ' A' ' 3' ' ' MET . 0.0 OUTLIER -118.34 91.2 40.42 Favored Pre-proline 0 CA--C 1.561 1.395 0 C-N-CA 123.546 0.738 . . . . 0.0 110.37 179.456 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -70.84 -32.59 13.83 Favored 'Trans proline' 0 C--N 1.381 2.267 0 C-N-CA 122.63 2.22 . . . . 0.0 112.737 178.076 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 41.2 p -107.75 96.57 6.48 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.686 0.795 . . . . 0.0 109.151 174.313 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 19.3 m -91.97 53.42 2.18 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.624 0.77 . . . . 0.0 109.212 178.212 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -82.82 78.54 9.4 Favored 'General case' 0 CA--C 1.544 0.75 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.56 -171.609 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.613 ' HB3' ' HG ' ' A' ' 10' ' ' LEU . 10.2 mm-40 61.33 -178.08 0.12 Allowed 'General case' 0 CA--C 1.558 1.257 0 C-N-CA 125.364 1.465 . . . . 0.0 113.851 163.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -116.58 18.77 14.91 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.937 0.895 . . . . 0.0 108.741 172.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.674 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 58.9 mt -84.02 169.64 14.76 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.256 0.622 . . . . 0.0 111.856 -167.477 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 42.6 t -61.33 118.98 42.12 Favored Pre-proline 0 CA--C 1.549 0.936 0 CA-C-N 115.041 -0.981 . . . . 0.0 109.705 177.19 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -71.07 -3.58 13.14 Favored 'Trans proline' 0 C--N 1.379 2.182 0 C-N-CA 123.082 2.521 . . . . 0.0 113.498 -175.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 61.1 mt -91.95 -22.69 5.95 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.311 0 C-N-CA 124.367 1.067 . . . . 0.0 110.529 177.376 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 71.2 m -124.75 -51.38 1.71 Allowed 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.257 0.623 . . . . 0.0 112.073 -167.033 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 90.8 m-85 71.69 -8.83 1.02 Allowed 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 125.669 1.588 . . . . 0.0 113.587 179.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -100.4 -14.22 18.42 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 118.962 0.801 . . . . 0.0 111.513 179.022 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 85.2 m-70 -138.68 149.45 62.37 Favored Pre-proline 0 N--CA 1.485 1.296 0 C-N-CA 123.403 0.681 . . . . 0.0 109.74 177.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.674 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 64.2 Cg_endo -68.95 174.33 8.95 Favored 'Trans proline' 0 C--N 1.383 2.392 0 C-N-CA 123.422 2.748 . . . . 0.0 114.572 -177.429 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 73.2 mt -72.7 127.78 34.98 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 N-CA-C 107.718 -1.215 . . . . 0.0 107.718 167.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 51.5 p -142.65 15.27 1.97 Allowed 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.191 0.596 . . . . 0.0 111.531 -174.358 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -154.82 149.34 26.32 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.544 0.738 . . . . 0.0 110.242 -176.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.7 p -140.69 126.53 20.23 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 175.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -87.16 104.73 16.64 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.905 0.882 . . . . 0.0 109.429 -172.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -100.63 142.91 25.53 Favored Pre-proline 0 CA--C 1.556 1.186 0 C-N-CA 123.972 0.909 . . . . 0.0 109.587 -175.009 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.46 ' HD3' ' HB ' ' A' ' 53' ' ' VAL . 85.8 Cg_endo -96.31 89.88 0.12 OUTLIER 'Cis proline' 0 C--N 1.382 2.29 0 CA-C-N 120.073 1.062 . . . . 0.0 112.411 -1.764 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 47.8 t -142.95 -39.84 0.33 Allowed 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 116.095 -0.502 . . . . 0.0 112.056 173.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 100.88 -16.28 57.55 Favored Glycine 0 C--N 1.349 1.269 0 CA-C-O 118.96 -0.911 . . . . 0.0 114.339 175.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.574 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 11.6 m170 -59.77 134.18 56.79 Favored 'General case' 0 N--CA 1.489 1.507 0 CA-C-N 117.789 0.795 . . . . 0.0 110.266 174.865 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -116.57 160.23 20.96 Favored 'General case' 0 C--O 1.238 0.471 0 C-N-CA 123.814 0.846 . . . . 0.0 111.039 -173.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 45.2 t -174.4 -176.19 1.06 Allowed 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.292 1.437 . . . . 0.0 108.57 -177.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 16.1 p -89.75 151.4 21.85 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 173.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.1 -25.16 67.97 Favored 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -178.269 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.2 -41.55 88.82 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.489 0.716 . . . . 0.0 111.499 174.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.7 m -56.87 -56.6 19.5 Favored 'General case' 0 N--CA 1.477 0.92 0 O-C-N 124.255 0.972 . . . . 0.0 111.109 178.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.52 HG12 HG23 ' A' ' 55' ' ' VAL . 8.0 tp -69.41 -38.97 78.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 O-C-N 123.578 0.549 . . . . 0.0 110.8 -171.624 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 86.6 m-20 -62.93 -37.64 87.83 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 122.728 0.411 . . . . 0.0 110.992 176.563 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 63.8 tt0 -70.81 -34.17 71.45 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.187 0.595 . . . . 0.0 110.737 175.422 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 33.0 t60 -70.21 -34.71 73.24 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.743 0.817 . . . . 0.0 109.936 179.123 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.428 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 98.1 mt -72.83 -7.53 51.22 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.956 0.902 . . . . 0.0 111.798 -179.3 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 94.1 mmm -79.26 -16.96 55.63 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.47 0.708 . . . . 0.0 110.809 170.299 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 64.9 m-20 -116.9 -73.58 0.64 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.814 0.846 . . . . 0.0 109.644 -179.031 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -125.39 -167.26 1.66 Allowed 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 124.718 1.207 . . . . 0.0 110.328 -175.712 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 89.0 tttt -142.13 81.46 1.75 Allowed 'General case' 0 N--CA 1.476 0.866 0 CA-C-O 121.393 0.616 . . . . 0.0 109.808 178.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.465 ' HB3' ' HA ' ' A' ' 49' ' ' LYS . 15.2 m-20 -136.1 166.26 23.8 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-O 121.946 0.879 . . . . 0.0 110.89 -173.735 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.574 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 41.9 t -92.9 29.68 1.76 Allowed 'General case' 0 N--CA 1.48 1.034 0 CA-C-N 113.818 -1.537 . . . . 0.0 110.564 178.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 63.4 -85.69 0.02 OUTLIER 'General case' 0 C--N 1.358 0.953 0 C-N-CA 125.197 1.399 . . . . 0.0 112.698 172.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 43.8 m-85 -64.2 -51.82 61.88 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.579 1.152 . . . . 0.0 111.014 -166.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 20.2 p -93.19 -11.8 31.85 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.561 -178.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.526 ' HZ2' ' HB2' ' A' ' 49' ' ' LYS . 0.1 OUTLIER 61.21 27.51 17.24 Favored 'General case' 0 N--CA 1.495 1.797 0 C-N-CA 124.987 1.315 . . . . 0.0 113.26 -176.452 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 85.5 m -65.42 118.91 10.08 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.039 0.535 . . . . 0.0 109.625 169.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 85.3 m -56.1 129.29 39.36 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.313 0.645 . . . . 0.0 110.528 179.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.425 HG13 HD13 ' A' ' 35' ' ' ILE . 40.2 mm -63.7 126.09 21.61 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.775 0 C-N-CA 122.971 0.508 . . . . 0.0 111.48 -174.642 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.46 ' HB ' ' HD3' ' A' ' 25' ' ' PRO . 60.9 t -97.67 -42.9 11.9 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 169.434 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.1 t -153.9 151.95 30.05 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.927 0.891 . . . . 0.0 110.255 177.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.52 HG23 HG12 ' A' ' 35' ' ' ILE . 43.1 t -124.5 122.44 63.9 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 169.83 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -93.04 150.98 20.15 Favored 'General case' 0 C--O 1.242 0.671 0 C-N-CA 122.881 0.472 . . . . 0.0 110.679 179.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -76.02 95.85 3.68 Favored 'General case' 0 C--O 1.242 0.704 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 172.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 61.4 t90 -84.92 117.62 24.03 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 -177.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -111.41 128.36 55.96 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.268 1.027 . . . . 0.0 109.532 177.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 27.6 ttpp -87.2 129.76 34.83 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 174.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.955 0 CA-C-O 118.724 -1.042 . . . . 0.0 110.922 -177.104 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 39.1 m . . . . . 0 N--CA 1.477 0.925 0 N-CA-C 110.291 -0.262 . . . . 0.0 110.291 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 45.1 t-80 -66.87 -59.31 3.64 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 123.847 0.859 . . . . 0.0 110.241 172.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 24.4 ptp -123.18 143.67 41.53 Favored Pre-proline 0 N--CA 1.476 0.865 0 C-N-CA 123.504 0.722 . . . . 0.0 109.63 178.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -81.8 128.43 5.92 Favored 'Trans proline' 0 C--N 1.372 1.782 0 C-N-CA 122.625 2.217 . . . . 0.0 111.446 171.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 49.3 p -78.72 152.96 31.26 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 123.244 0.618 . . . . 0.0 109.353 173.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.475 ' HB3' ' O ' ' A' ' 16' ' ' ALA . 23.3 t -157.7 118.43 3.49 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 69.46 177.86 0.26 Allowed 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 125.251 1.421 . . . . 0.0 111.509 -172.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -129.43 173.46 10.53 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 124.731 1.212 . . . . 0.0 109.443 172.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 57.12 55.38 6.04 Favored 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 -160.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.579 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 96.9 mt -69.81 142.91 53.06 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 114.192 -1.367 . . . . 0.0 112.162 -171.726 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.535 ' SG ' ' HB2' ' A' ' 30' ' ' SER . 47.5 t -62.58 113.22 8.29 Favored Pre-proline 0 CA--C 1.538 0.486 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 169.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -58.73 -20.29 50.43 Favored 'Trans proline' 0 C--N 1.373 1.821 0 C-N-CA 122.921 2.414 . . . . 0.0 113.894 -172.07 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.8 mp -80.93 -49.7 17.89 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.159 0 C-N-CA 123.686 0.795 . . . . 0.0 110.393 176.364 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 95.8 m -79.84 -47.57 14.93 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.23 0.612 . . . . 0.0 112.469 -170.179 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 74.66 -37.96 0.37 Allowed 'General case' 0 N--CA 1.497 1.878 0 C-N-CA 126.076 1.751 . . . . 0.0 113.14 -174.592 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.475 ' O ' ' HB3' ' A' ' 6' ' ' SER . . . -91.2 0.47 57.52 Favored 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 112.914 0.709 . . . . 0.0 112.914 -175.357 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 92.1 m-70 -146.63 151.33 42.58 Favored Pre-proline 0 N--CA 1.49 1.539 0 C-N-CA 123.833 0.853 . . . . 0.0 108.812 177.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.579 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 78.7 Cg_endo -77.49 -169.8 0.82 Allowed 'Trans proline' 0 C--N 1.378 2.087 0 C-N-CA 123.528 2.819 . . . . 0.0 114.275 -175.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 84.8 mt -85.94 155.12 3.42 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.346 0 C-N-CA 124.685 1.194 . . . . 0.0 110.732 177.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 34.8 t -141.56 -10.96 0.92 Allowed 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 124.049 0.94 . . . . 0.0 111.511 177.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -149.94 146.73 27.22 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.094 0.558 . . . . 0.0 111.605 -170.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.6 p -111.66 141.03 28.34 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 124.293 1.037 . . . . 0.0 110.22 175.011 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 17.7 m-85 -97.72 96.16 8.06 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.647 0.779 . . . . 0.0 108.957 176.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 36.3 mt-30 -90.26 148.83 40.06 Favored Pre-proline 0 CA--C 1.543 0.698 0 C-N-CA 123.344 0.658 . . . . 0.0 110.983 -179.273 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -88.18 13.92 50.0 Favored 'Cis proline' 0 C--N 1.38 2.197 0 N-CA-C 114.606 0.964 . . . . 0.0 114.606 4.473 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 52.2 t -67.08 -70.41 0.25 Allowed 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -173.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 130.4 -24.2 4.45 Favored Glycine 0 C--N 1.347 1.172 0 CA-C-O 119.487 -0.618 . . . . 0.0 113.052 -177.096 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.559 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 25.6 m170 -61.29 145.77 50.26 Favored 'General case' 0 N--CA 1.486 1.363 0 CA-C-N 117.427 0.613 . . . . 0.0 110.168 171.546 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 60.4 mttp -136.82 161.32 36.32 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.404 0.682 . . . . 0.0 111.001 -171.127 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.535 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 51.3 p -165.41 -174.47 3.19 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.201 1.0 . . . . 0.0 108.99 173.153 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 17.4 p -79.17 156.35 28.25 Favored 'General case' 0 C--O 1.246 0.898 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 173.133 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -64.41 -26.61 68.53 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.302 0.641 . . . . 0.0 112.302 -177.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.37 -35.35 77.21 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.063 0.545 . . . . 0.0 111.937 176.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 17.6 m -69.28 -43.73 73.3 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.306 0.642 . . . . 0.0 111.564 179.031 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.524 HG12 HG23 ' A' ' 55' ' ' VAL . 9.8 tp -75.96 -31.73 22.43 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 CA-C-O 119.662 -0.209 . . . . 0.0 110.928 -177.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 58.6 t30 -61.25 -44.81 96.63 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 174.106 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 42.6 tt0 -58.46 -44.0 89.11 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 124.76 1.224 . . . . 0.0 110.907 173.004 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 49.4 t60 -71.69 -35.22 70.19 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.492 -172.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 90.6 mt -69.61 -11.91 61.21 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.397 0.679 . . . . 0.0 112.126 -178.267 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 19.3 mmt -78.56 -14.89 59.11 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 123.87 0.868 . . . . 0.0 110.585 173.016 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 21.1 m-80 -115.98 -75.84 0.58 Allowed 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.505 1.122 . . . . 0.0 109.416 -178.213 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 49.4 m-80 -132.22 -170.93 2.52 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 124.319 1.047 . . . . 0.0 110.01 -176.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -132.68 29.41 4.18 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 123.379 0.672 . . . . 0.0 110.025 177.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.421 ' HA ' ' HA ' ' A' ' 51' ' ' THR . 23.8 m-20 -89.76 161.11 16.21 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.748 0.819 . . . . 0.0 110.992 178.477 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.559 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 40.8 t -91.7 60.43 3.97 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.195 0.598 . . . . 0.0 111.762 -175.58 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 36.0 m-85 47.71 -90.84 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 126.183 1.793 . . . . 0.0 113.922 168.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 -73.51 -56.84 4.51 Favored 'General case' 0 C--N 1.354 0.804 0 C-N-CA 123.775 0.83 . . . . 0.0 110.879 -169.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 13.1 p -77.83 -20.39 53.24 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.857 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 1.2 tmtp? 69.29 1.46 3.27 Favored 'General case' 0 CA--C 1.564 1.514 0 C-N-CA 125.133 1.373 . . . . 0.0 113.433 176.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 29.1 m -56.79 120.98 8.78 Favored 'General case' 0 CA--C 1.551 1.006 0 O-C-N 121.593 -0.692 . . . . 0.0 110.041 175.438 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.421 ' HA ' ' HA ' ' A' ' 44' ' ' ASP . 21.4 m -59.98 129.25 40.87 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.16 0.584 . . . . 0.0 111.053 -174.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.487 HG21 HG22 ' A' ' 55' ' ' VAL . 17.1 mt -81.62 127.75 39.31 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 C-N-CA 124.052 0.941 . . . . 0.0 109.552 -175.129 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 78.0 t -74.97 -50.61 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 N-CA-C 109.273 -0.639 . . . . 0.0 109.273 173.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 33.0 t -147.4 134.67 20.6 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.214 -179.3 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.524 HG23 HG12 ' A' ' 35' ' ' ILE . 44.2 t -98.87 103.03 14.19 Favored 'Isoleucine or valine' 0 C--O 1.239 0.526 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 175.073 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -91.91 169.17 10.89 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 177.091 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -82.49 150.28 27.1 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 170.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 81.6 t90 -131.55 117.44 18.76 Favored 'General case' 0 C--O 1.243 0.756 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 173.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -116.26 124.67 50.77 Favored 'General case' 0 C--O 1.243 0.721 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 170.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.18 152.02 17.93 Favored 'General case' 0 CA--C 1.556 1.185 0 C-N-CA 124.518 1.127 . . . . 0.0 111.9 175.656 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.343 0.959 0 CA-C-O 119.077 -0.846 . . . . 0.0 110.998 -178.753 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 31.0 m . . . . . 0 N--CA 1.475 0.776 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 13.5 p80 -84.75 132.74 34.41 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.354 0.662 . . . . 0.0 110.238 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 53.2 ttp -161.37 81.57 1.99 Allowed Pre-proline 0 CA--C 1.548 0.869 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 174.72 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -64.85 85.18 0.17 Allowed 'Trans proline' 0 C--N 1.383 2.355 0 C-N-CA 123.163 2.576 . . . . 0.0 111.757 176.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 31.6 m -88.17 84.07 6.93 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.638 -177.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 47.1 t -75.35 94.53 3.06 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 108.382 -0.969 . . . . 0.0 108.382 172.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -150.29 179.58 8.0 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.242 -169.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -79.87 167.88 19.97 Favored 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 123.654 0.782 . . . . 0.0 111.688 -173.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.405 ' HB3' HD12 ' A' ' 19' ' ' ILE . 9.2 m-20 -66.42 75.39 0.1 Allowed 'General case' 0 C--N 1.359 0.983 0 C-N-CA 124.762 1.225 . . . . 0.0 108.465 165.521 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.658 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 96.6 mt -79.32 152.14 30.64 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 114.204 -1.362 . . . . 0.0 110.471 -179.802 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 35.4 t -61.74 116.34 20.39 Favored Pre-proline 0 CA--C 1.545 0.762 0 O-C-N 124.032 0.832 . . . . 0.0 108.952 172.436 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -64.95 -7.66 15.82 Favored 'Trans proline' 0 C--N 1.373 1.849 0 C-N-CA 123.029 2.486 . . . . 0.0 113.476 -172.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.3 mp -90.93 -54.09 7.97 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.151 0 C-N-CA 124.096 0.958 . . . . 0.0 109.436 172.05 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 70.7 m -83.73 -58.63 2.72 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 122.958 0.503 . . . . 0.0 112.333 -171.006 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.431 ' HA ' ' HB3' ' A' ' 10' ' ' LEU . 92.1 m-85 75.3 -36.23 0.3 Allowed 'General case' 0 N--CA 1.494 1.739 0 C-N-CA 126.243 1.817 . . . . 0.0 111.996 -170.734 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.92 -27.84 67.09 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 124.322 1.049 . . . . 0.0 112.452 178.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 42.3 m80 -135.48 154.8 78.65 Favored Pre-proline 0 CA--C 1.557 1.214 0 C-N-CA 124.345 1.058 . . . . 0.0 109.977 176.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.658 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 84.7 Cg_endo -73.98 -165.08 0.24 Allowed 'Trans proline' 0 C--N 1.378 2.125 0 C-N-CA 123.361 2.707 . . . . 0.0 114.678 -175.631 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.405 HD12 ' HB3' ' A' ' 9' ' ' ASP . 83.4 mt -84.09 150.24 4.17 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.0 0 C-N-CA 124.139 0.976 . . . . 0.0 110.416 175.346 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 6.9 m -138.99 -26.54 0.84 Allowed 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.752 0.821 . . . . 0.0 111.317 -178.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -139.7 140.08 36.74 Favored 'General case' 0 C--O 1.241 0.644 0 C-N-CA 123.608 0.763 . . . . 0.0 110.386 -174.338 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.6 p -102.89 139.93 22.53 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 C-N-CA 123.923 0.889 . . . . 0.0 109.974 175.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 10.4 m-85 -88.25 88.28 7.58 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 176.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -85.1 139.68 36.78 Favored Pre-proline 0 CA--C 1.553 1.059 0 CA-C-N 115.067 -0.97 . . . . 0.0 110.208 -172.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -95.71 15.16 39.36 Favored 'Cis proline' 0 C--N 1.386 2.519 0 N-CA-C 114.853 1.059 . . . . 0.0 114.853 4.242 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 44.7 t -59.96 -59.74 4.94 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -173.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 123.71 -28.89 5.34 Favored Glycine 0 C--N 1.344 0.998 0 CA-C-O 119.299 -0.723 . . . . 0.0 113.035 -177.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.531 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 13.7 m170 -55.26 139.49 42.29 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 171.454 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 57.9 mttp -129.94 170.62 13.71 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 123.294 0.638 . . . . 0.0 110.642 -177.453 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 47.9 t -175.3 177.19 1.9 Allowed 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.846 1.258 . . . . 0.0 108.624 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 14.3 p -77.38 153.57 33.58 Favored 'General case' 0 C--O 1.25 1.13 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 172.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 48.4 tttm -65.25 -29.54 70.34 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 123.252 0.621 . . . . 0.0 111.334 -173.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -58.54 -43.35 89.23 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.503 0.721 . . . . 0.0 111.49 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 10.9 m -59.27 -51.8 68.42 Favored 'General case' 0 N--CA 1.479 1.021 0 O-C-N 124.029 0.831 . . . . 0.0 111.72 178.457 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.415 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 7.6 tp -73.12 -34.73 45.87 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.779 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.131 -172.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -60.7 -43.03 98.29 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 122.523 0.329 . . . . 0.0 110.246 174.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 7.3 tp60 -65.72 -34.84 79.14 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.835 175.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 57.9 t60 -69.21 -43.15 74.71 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.615 0.766 . . . . 0.0 110.329 -178.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.415 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 78.7 mt -66.96 -14.54 62.94 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 124.533 1.133 . . . . 0.0 112.118 -176.735 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 96.2 mmm -64.97 -16.21 63.11 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.591 0.757 . . . . 0.0 111.422 172.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -133.92 -68.25 0.57 Allowed 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.728 0.811 . . . . 0.0 110.057 174.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 88.1 m-20 -106.13 157.12 17.78 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 124.104 0.961 . . . . 0.0 111.088 -172.093 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.412 ' HD2' ' N ' ' A' ' 43' ' ' LYS . 9.4 mptt -115.68 25.36 10.83 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 123.213 0.605 . . . . 0.0 109.457 179.312 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 50.3 m-20 -91.73 163.15 14.18 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 115.439 -0.8 . . . . 0.0 111.841 -172.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.531 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 43.5 t -93.19 50.23 1.5 Allowed 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.805 0.842 . . . . 0.0 111.301 -176.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 52.44 -84.03 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 125.561 1.544 . . . . 0.0 114.233 170.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 90.9 m-85 -73.8 -62.86 1.35 Allowed 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.126 0.97 . . . . 0.0 110.901 -170.012 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 15.9 p -75.59 -18.97 59.57 Favored 'General case' 0 N--CA 1.48 1.057 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.758 179.291 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt 66.83 13.43 9.4 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 125.073 1.349 . . . . 0.0 113.934 176.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 29.8 m -66.78 125.15 24.96 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 176.014 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 49.1 m -60.27 121.96 13.29 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-O 120.974 0.416 . . . . 0.0 110.214 -179.174 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 38.0 mt -72.61 133.26 32.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 C-N-CA 124.517 1.127 . . . . 0.0 109.987 -174.234 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 90.8 t -77.75 -41.97 28.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 O-C-N 123.647 0.592 . . . . 0.0 109.654 177.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 77.2 p -152.78 134.54 14.63 Favored 'General case' 0 C--O 1.242 0.699 0 C-N-CA 122.76 0.424 . . . . 0.0 110.754 176.356 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 59.8 t -87.7 104.57 14.51 Favored 'Isoleucine or valine' 0 C--O 1.244 0.796 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 170.23 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -103.0 139.46 38.54 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 -172.304 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -70.85 96.15 1.23 Allowed 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.029 0.932 . . . . 0.0 109.502 -178.533 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 88.2 t90 -82.37 128.62 34.41 Favored 'General case' 0 C--O 1.24 0.595 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.768 -177.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -133.77 141.09 47.34 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 177.226 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 62.8 mttm -61.21 -48.52 81.11 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.932 0.893 . . . . 0.0 111.889 -179.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.226 0 CA-C-O 119.175 -0.792 . . . . 0.0 112.085 -174.078 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 31.3 t . . . . . 0 N--CA 1.477 0.889 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 87.1 m-70 -93.94 89.34 6.05 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.113 0.565 . . . . 0.0 109.51 179.38 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 21.4 ptt? -149.64 80.09 7.69 Favored Pre-proline 0 CA--C 1.558 1.286 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.11 179.443 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -73.56 121.78 7.36 Favored 'Trans proline' 0 C--N 1.371 1.754 0 C-N-CA 122.264 1.976 . . . . 0.0 110.439 172.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 4.6 t -70.98 82.46 0.67 Allowed 'General case' 0 CA--C 1.553 1.068 0 CA-C-O 122.464 1.126 . . . . 0.0 110.321 -178.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 43.0 m -79.57 107.86 12.67 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 114.174 -1.375 . . . . 0.0 109.538 -177.1 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -81.55 78.51 8.29 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 123.903 0.881 . . . . 0.0 110.314 -175.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.526 ' HB2' ' HG ' ' A' ' 10' ' ' LEU . 37.2 mt-10 -132.19 -173.64 3.21 Favored 'General case' 0 C--O 1.244 0.811 0 C-N-CA 124.78 1.232 . . . . 0.0 108.179 177.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -85.36 54.94 3.29 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-O 121.752 0.787 . . . . 0.0 109.208 171.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.684 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 96.3 mt -85.43 141.7 29.77 Favored 'General case' 0 C--N 1.349 0.573 0 CA-C-N 115.123 -0.944 . . . . 0.0 109.263 177.326 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 52.1 t -58.61 115.28 11.09 Favored Pre-proline 0 CA--C 1.547 0.841 0 O-C-N 124.234 0.959 . . . . 0.0 109.847 -178.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_endo -58.71 -22.22 60.06 Favored 'Trans proline' 0 N--CA 1.502 2.027 0 C-N-CA 123.141 2.561 . . . . 0.0 113.537 -174.38 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 77.3 mt -80.5 -40.03 19.14 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.338 0 C-N-CA 124.115 0.966 . . . . 0.0 111.14 178.313 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 76.5 m -102.72 -54.48 2.64 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 123.616 0.766 . . . . 0.0 111.226 -170.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 1.7 t80 81.9 -35.87 0.1 Allowed 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 126.616 1.966 . . . . 0.0 111.719 175.36 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.01 -33.63 70.56 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.23 0.612 . . . . 0.0 111.684 179.06 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 41.3 m170 -114.1 150.18 43.18 Favored Pre-proline 0 N--CA 1.483 1.178 0 C-N-CA 123.91 0.884 . . . . 0.0 109.321 179.132 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.684 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 49.4 Cg_endo -79.26 -165.02 0.31 Allowed 'Trans proline' 0 C--N 1.378 2.111 0 C-N-CA 122.924 2.416 . . . . 0.0 113.142 -174.267 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.449 HG22 ' HB3' ' A' ' 29' ' ' LYS . 97.9 mt -86.43 145.09 8.15 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.511 0 C-N-CA 123.946 0.898 . . . . 0.0 109.217 170.889 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.2 m -130.41 -19.99 3.02 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.695 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -137.68 133.77 34.64 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 122.833 0.453 . . . . 0.0 111.91 -168.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.7 p -106.57 140.78 23.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 124.833 1.253 . . . . 0.0 109.418 171.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.522 ' HZ ' ' HG ' ' A' ' 30' ' ' SER . 8.0 m-85 -105.47 93.86 4.9 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.07 0.548 . . . . 0.0 110.0 -171.005 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -66.81 144.04 98.36 Favored Pre-proline 0 CA--C 1.547 0.829 0 C-N-CA 123.368 0.667 . . . . 0.0 111.144 175.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -85.51 0.25 63.69 Favored 'Cis proline' 0 C--N 1.377 2.035 0 N-CA-C 114.216 0.814 . . . . 0.0 114.216 -1.302 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 51.1 t -64.82 -59.74 3.87 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 -168.174 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 116.73 -16.12 13.99 Favored Glycine 0 C--N 1.346 1.129 0 CA-C-O 119.084 -0.842 . . . . 0.0 114.077 -177.311 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.66 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 9.8 m170 -63.62 161.3 15.05 Favored 'General case' 0 N--CA 1.49 1.558 0 CA-C-N 117.98 0.89 . . . . 0.0 110.515 176.15 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.449 ' HB3' HG22 ' A' ' 19' ' ' ILE . 40.3 mtmt -151.35 144.8 24.85 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 115.401 -0.818 . . . . 0.0 112.615 -161.376 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.522 ' HG ' ' HZ ' ' A' ' 23' ' ' PHE . 59.8 p -156.47 -178.59 7.45 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.324 1.05 . . . . 0.0 109.006 170.545 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 16.8 p -72.05 162.06 30.0 Favored 'General case' 0 C--O 1.247 0.96 0 C-N-CA 122.518 0.327 . . . . 0.0 110.449 178.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 32.8 ttmt -55.94 -42.55 76.33 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.316 1.046 . . . . 0.0 110.909 177.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -56.7 -44.89 81.98 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.241 1.016 . . . . 0.0 112.465 -176.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 32.3 m -61.72 -54.94 35.81 Favored 'General case' 0 N--CA 1.481 1.105 0 O-C-N 123.776 0.673 . . . . 0.0 110.868 179.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 9.0 tp -72.54 -28.02 27.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 C-N-CA 122.796 0.438 . . . . 0.0 111.762 -172.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 50.4 t-20 -66.54 -51.78 52.8 Favored 'General case' 0 N--CA 1.486 1.325 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 178.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -69.41 -26.38 64.6 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 114.946 -1.025 . . . . 0.0 111.495 177.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 48.4 t60 -71.33 -41.34 69.96 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.301 0.64 . . . . 0.0 110.216 178.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 92.8 mt -75.08 0.2 16.89 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 123.193 0.597 . . . . 0.0 112.459 -179.006 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 86.3 mtp -80.09 -35.81 36.36 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.478 0.711 . . . . 0.0 109.317 166.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -106.28 -73.5 0.68 Allowed 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.136 0.975 . . . . 0.0 110.981 -173.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 -103.06 -168.6 1.54 Allowed 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 124.345 1.058 . . . . 0.0 110.703 -175.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.407 ' HG3' HG23 ' A' ' 51' ' ' THR . 59.6 pttt -150.55 22.33 0.81 Allowed 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.54 0.736 . . . . 0.0 109.845 176.312 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -97.84 165.39 11.96 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.796 0.838 . . . . 0.0 112.093 -174.062 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.66 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 48.9 t -91.73 39.24 1.0 Allowed 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 124.001 0.921 . . . . 0.0 111.889 -171.636 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 57.05 -84.98 0.02 OUTLIER 'General case' 0 CA--C 1.559 1.314 0 C-N-CA 125.3 1.44 . . . . 0.0 113.156 172.351 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 84.0 m-85 -78.17 -60.41 2.38 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.268 1.027 . . . . 0.0 111.474 -167.275 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 14.2 p -72.13 -21.15 61.51 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-N 117.7 0.227 . . . . 0.0 110.873 178.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 8.3 tmtt? 62.01 39.13 13.61 Favored 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 124.803 1.241 . . . . 0.0 111.019 175.284 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 25.2 m -88.63 137.09 32.64 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 166.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.407 HG23 ' HG3' ' A' ' 43' ' ' LYS . 29.1 m -68.17 120.66 14.72 Favored 'General case' 0 CA--C 1.554 1.1 0 CA-C-N 118.305 0.502 . . . . 0.0 110.406 -178.706 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 55.4 mt -67.44 131.25 33.05 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 C-N-CA 123.845 0.858 . . . . 0.0 110.115 -179.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 93.2 t -87.58 -40.58 13.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 122.855 0.462 . . . . 0.0 110.005 175.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.1 t -152.06 140.57 20.67 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 122.742 0.417 . . . . 0.0 110.754 -178.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 41.4 t -105.95 128.96 59.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 N-CA-C 108.739 -0.838 . . . . 0.0 108.739 175.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.5 mm-40 -118.33 157.31 27.33 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.64 1.176 . . . . 0.0 109.56 178.039 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -81.88 108.7 15.61 Favored 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 174.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 61.1 t90 -84.47 107.29 16.64 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 122.89 0.476 . . . . 0.0 109.744 178.29 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -112.41 113.51 25.74 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.351 0.661 . . . . 0.0 109.631 175.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 36.7 ttpt -80.05 117.86 21.26 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.412 0.685 . . . . 0.0 109.94 -179.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 1.617 0 CA-C-O 118.495 -1.169 . . . . 0.0 112.308 173.692 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 45.2 m . . . . . 0 N--CA 1.486 1.329 0 CA-C-O 120.576 0.227 . . . . 0.0 111.358 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 54.3 t60 -88.26 123.66 33.1 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 123.5 0.72 . . . . 0.0 111.121 -173.012 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 57.4 mtt -73.8 145.02 83.66 Favored Pre-proline 0 CA--C 1.553 1.072 0 C-N-CA 123.909 0.883 . . . . 0.0 110.946 176.433 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -53.87 92.83 0.04 OUTLIER 'Trans proline' 0 C--N 1.391 2.776 0 C-N-CA 123.906 3.071 . . . . 0.0 114.516 -172.624 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 18.7 p -138.29 -42.31 0.51 Allowed 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 125.122 1.369 . . . . 0.0 108.586 172.116 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.576 ' HB3' HD12 ' A' ' 10' ' ' LEU . 63.7 m -72.82 90.46 1.44 Allowed 'General case' 0 C--O 1.24 0.595 0 CA-C-N 115.261 -0.881 . . . . 0.0 108.94 171.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.507 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 41.6 mt-10 -62.04 131.36 49.35 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 115.087 -0.96 . . . . 0.0 110.017 -176.507 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -72.99 22.03 0.07 Allowed 'General case' 0 CA--C 1.559 1.302 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 -165.15 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -79.58 -0.3 33.0 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 124.344 1.058 . . . . 0.0 110.883 168.301 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.659 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 41.2 mt -63.32 148.63 47.81 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.106 0.962 . . . . 0.0 112.545 -174.16 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 11.8 t -58.66 108.08 1.19 Allowed Pre-proline 0 CA--C 1.549 0.935 0 CA-C-O 117.903 -1.046 . . . . 0.0 109.413 168.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -65.9 -13.16 38.53 Favored 'Trans proline' 0 C--N 1.381 2.265 0 C-N-CA 123.148 2.566 . . . . 0.0 113.237 -171.751 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 55.8 mt -67.71 -23.89 30.16 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.499 0 C-N-CA 124.03 0.932 . . . . 0.0 110.902 173.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 59.4 m -131.03 -55.09 1.05 Allowed 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 124.106 0.963 . . . . 0.0 111.235 -170.015 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 26.0 t80 75.69 28.3 0.93 Allowed 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 126.104 1.762 . . . . 0.0 109.907 178.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -104.28 -51.48 3.11 Favored 'General case' 0 CA--C 1.552 1.023 0 CA-C-N 115.469 -0.787 . . . . 0.0 112.246 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 12.2 m-70 -121.93 141.62 34.49 Favored Pre-proline 0 N--CA 1.495 1.806 0 C-N-CA 123.65 0.78 . . . . 0.0 109.948 -173.631 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.659 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 45.8 Cg_endo -84.15 47.26 2.19 Favored 'Trans proline' 0 C--N 1.386 2.539 0 C-N-CA 123.717 2.945 . . . . 0.0 114.796 -171.776 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.429 HG23 ' HB3' ' A' ' 29' ' ' LYS . 77.6 mt 68.21 143.63 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.352 0 C-N-CA 125.164 1.386 . . . . 0.0 112.649 172.273 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.0 t -155.11 19.9 0.43 Allowed 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 122.721 0.408 . . . . 0.0 111.144 176.091 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.471 ' HB3' ' HD2' ' A' ' 32' ' ' LYS . . . -139.97 132.23 28.24 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 122.879 0.472 . . . . 0.0 109.8 176.211 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.4 p -113.24 132.98 60.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 C-N-CA 123.486 0.714 . . . . 0.0 109.236 173.066 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 14.5 m-85 -87.84 90.49 8.4 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 -178.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -73.2 136.93 78.77 Favored Pre-proline 0 CA--C 1.553 1.089 0 CA-C-N 114.136 -1.393 . . . . 0.0 109.89 -178.215 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -98.15 20.34 26.46 Favored 'Cis proline' 0 C--N 1.374 1.911 0 N-CA-C 114.595 0.96 . . . . 0.0 114.595 -3.085 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 41.5 t -62.67 -65.6 0.66 Allowed 'General case' 0 N--CA 1.482 1.126 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -175.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 128.86 -25.68 4.63 Favored Glycine 0 C--N 1.35 1.347 0 CA-C-O 119.553 -0.582 . . . . 0.0 113.465 -178.001 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.638 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 26.4 m80 -63.06 147.78 49.72 Favored 'General case' 0 N--CA 1.484 1.259 0 CA-C-N 117.212 0.506 . . . . 0.0 109.64 171.077 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.429 ' HB3' HG23 ' A' ' 19' ' ' ILE . 96.1 mttt -133.95 168.92 17.9 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.926 0.89 . . . . 0.0 110.41 -173.567 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 21.2 t -168.81 177.57 4.99 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.604 0.762 . . . . 0.0 110.662 177.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 12.8 p -80.45 153.74 28.05 Favored 'General case' 0 C--O 1.246 0.876 0 CA-C-N 115.573 -0.739 . . . . 0.0 109.217 175.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.471 ' HD2' ' HB3' ' A' ' 21' ' ' ALA . 14.9 mmmm -57.96 -39.68 78.73 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.801 0.84 . . . . 0.0 112.366 -172.522 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -64.65 -35.95 82.69 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.783 0.833 . . . . 0.0 112.293 -176.246 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.8 m -59.0 -56.52 21.26 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.05 0.54 . . . . 0.0 111.238 177.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 8.4 tp -76.1 -31.32 21.42 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 CA-C-N 115.483 -0.78 . . . . 0.0 111.398 -172.115 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -63.73 -40.22 96.21 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-O 121.0 0.429 . . . . 0.0 110.465 177.138 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -76.12 -35.29 59.34 Favored 'General case' 0 CA--C 1.547 0.851 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.834 176.16 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 84.5 t60 -67.4 -42.97 82.43 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.371 0.668 . . . . 0.0 110.977 -175.277 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 67.9 mt -58.89 -23.88 61.56 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 124.234 1.013 . . . . 0.0 112.573 -177.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 55.0 mtt -66.98 -32.42 73.64 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 123.515 0.726 . . . . 0.0 110.756 176.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -100.73 -67.9 0.84 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 124.278 1.031 . . . . 0.0 110.559 179.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -124.49 156.66 36.88 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 124.019 0.928 . . . . 0.0 111.479 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 32.1 mtmm -102.45 17.47 23.5 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.247 0.619 . . . . 0.0 110.213 176.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 42.0 m-20 -88.18 151.74 22.48 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.499 0.72 . . . . 0.0 112.18 -169.151 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.638 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 39.2 t -88.64 58.7 4.78 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.658 0.783 . . . . 0.0 111.408 -177.069 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 42.97 -85.93 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 126.636 1.974 . . . . 0.0 115.094 171.347 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 53.1 m-85 -73.18 -38.23 66.24 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.384 1.074 . . . . 0.0 111.426 -165.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 16.2 p -102.63 -12.65 17.56 Favored 'General case' 0 N--CA 1.483 1.201 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.506 179.355 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? 54.26 17.74 1.6 Allowed 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 125.759 1.623 . . . . 0.0 113.691 -176.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 31.1 m -64.91 116.26 6.2 Favored 'General case' 0 C--N 1.35 0.594 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 174.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 13.1 m -60.13 116.15 3.99 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 122.879 0.472 . . . . 0.0 110.561 -173.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.424 HG21 HG21 ' A' ' 55' ' ' VAL . 37.6 mt -66.9 127.43 28.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 C-N-CA 124.733 1.213 . . . . 0.0 110.595 -171.537 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 29.0 t -80.89 -41.72 19.77 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.585 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 47.5 t -146.35 133.48 20.43 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.4 0.68 . . . . 0.0 109.483 177.398 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.424 HG21 HG21 ' A' ' 52' ' ' ILE . 45.9 t -98.54 104.14 15.59 Favored 'Isoleucine or valine' 0 C--O 1.245 0.853 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 172.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -91.29 143.66 26.41 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 122.785 0.434 . . . . 0.0 110.251 -178.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -76.77 108.44 9.79 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 173.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 37.6 t90 -91.83 128.3 37.61 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.79 0.836 . . . . 0.0 110.696 -176.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -87.44 122.99 31.89 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 169.631 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 34.4 tttm -85.2 -55.22 4.15 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.347 0.594 . . . . 0.0 110.769 -179.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.256 1.511 0 N-CA-C 109.869 -1.292 . . . . 0.0 109.869 -163.736 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 24.0 m . . . . . 0 C--O 1.242 0.669 0 N-CA-C 110.264 -0.272 . . . . 0.0 110.264 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 62.8 m-70 -70.91 87.78 0.73 Allowed 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 169.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 56.8 ttp -74.29 113.64 25.66 Favored Pre-proline 0 CA--C 1.549 0.924 0 CA-C-N 115.476 -0.783 . . . . 0.0 110.05 -171.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -73.48 -7.49 20.39 Favored 'Trans proline' 0 C--N 1.372 1.805 0 C-N-CA 122.822 2.348 . . . . 0.0 114.319 -172.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 75.1 p -68.15 98.51 0.8 Allowed 'General case' 0 CA--C 1.548 0.874 0 CA-C-O 121.073 0.463 . . . . 0.0 110.594 -178.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 27.1 m -75.26 -4.65 40.26 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 123.711 0.805 . . . . 0.0 111.544 178.534 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.566 ' HG3' HD21 ' A' ' 10' ' ' LEU . 10.0 pt-20 -80.02 123.69 28.05 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 123.252 0.621 . . . . 0.0 109.673 171.077 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 26.4 mm-40 -122.3 8.69 9.7 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.035 0.934 . . . . 0.0 111.212 -174.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -84.67 26.34 0.82 Allowed 'General case' 0 N--CA 1.493 1.683 0 C-N-CA 123.276 0.63 . . . . 0.0 110.767 173.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.583 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 35.4 mt -71.81 139.07 48.78 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.316 0.647 . . . . 0.0 111.904 -167.282 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 40.6 t -58.68 115.79 12.99 Favored Pre-proline 0 CA--C 1.549 0.937 0 CA-C-O 117.844 -1.074 . . . . 0.0 108.65 171.366 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_exo -52.56 -30.09 43.39 Favored 'Trans proline' 0 N--CA 1.506 2.212 0 C-N-CA 123.12 2.546 . . . . 0.0 114.066 -171.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 4.2 mp -77.04 -37.72 26.86 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.072 0 C-N-CA 124.109 0.964 . . . . 0.0 110.973 -177.339 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 73.9 m -106.07 -47.34 3.86 Favored 'General case' 0 N--CA 1.485 1.28 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 -167.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.421 ' HA ' ' HB3' ' A' ' 10' ' ' LEU . 53.4 m-85 77.78 -51.89 0.52 Allowed 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 126.637 1.975 . . . . 0.0 111.638 -174.898 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.13 -5.68 14.49 Favored 'General case' 0 N--CA 1.484 1.265 0 N-CA-C 114.374 1.25 . . . . 0.0 114.374 -170.35 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 28.1 m170 -135.58 132.88 19.91 Favored Pre-proline 0 N--CA 1.483 1.218 0 C-N-CA 123.412 0.685 . . . . 0.0 109.384 172.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.583 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 42.2 Cg_endo -86.2 71.31 4.18 Favored 'Trans proline' 0 C--N 1.377 2.054 0 C-N-CA 123.46 2.773 . . . . 0.0 114.386 -173.527 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 81.9 mt 61.88 170.42 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.499 2.024 0 C-N-CA 124.27 1.028 . . . . 0.0 111.017 176.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 70.3 m -156.31 -37.91 0.08 Allowed 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 124.074 0.95 . . . . 0.0 110.188 173.337 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -127.28 171.51 11.41 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.093 0.957 . . . . 0.0 111.24 -174.309 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 4.8 p -141.56 140.11 31.39 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 C-N-CA 124.305 1.042 . . . . 0.0 109.443 -179.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -88.3 96.4 10.56 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 124.202 1.001 . . . . 0.0 108.878 -178.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.7 tp60 -92.75 145.92 31.22 Favored Pre-proline 0 CA--C 1.555 1.137 0 CA-C-N 114.802 -1.09 . . . . 0.0 109.658 -174.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -93.59 37.53 5.92 Favored 'Cis proline' 0 C--N 1.378 2.091 0 CA-C-N 120.035 1.048 . . . . 0.0 114.431 -2.384 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 19.3 t -75.66 -78.64 0.11 Allowed 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 122.539 0.336 . . . . 0.0 111.399 176.021 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 141.44 -26.5 2.42 Favored Glycine 0 C--N 1.357 1.702 0 CA-C-O 119.724 -0.487 . . . . 0.0 113.198 -173.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.426 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 16.5 m80 -59.57 136.57 58.03 Favored 'General case' 0 N--CA 1.487 1.391 0 CA-C-N 117.144 0.472 . . . . 0.0 110.456 173.748 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -122.74 154.19 38.47 Favored 'General case' 0 C--O 1.238 0.447 0 C-N-CA 123.682 0.793 . . . . 0.0 110.445 -176.054 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 27.0 t -164.28 -168.91 1.66 Allowed 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.655 1.182 . . . . 0.0 107.842 -179.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 20.8 p -101.82 164.97 11.45 Favored 'General case' 0 N--CA 1.477 0.92 0 O-C-N 121.619 -0.676 . . . . 0.0 110.979 -179.465 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt -55.12 -42.84 73.47 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 124.576 1.151 . . . . 0.0 110.986 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.89 -44.84 94.01 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.743 0.817 . . . . 0.0 112.266 -177.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 7.0 m -58.57 -53.56 56.98 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 123.67 0.788 . . . . 0.0 112.195 -179.22 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 5.6 tp -70.75 -39.39 75.57 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.096 -174.22 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -61.95 -35.88 79.76 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.32 0.648 . . . . 0.0 110.858 177.488 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -73.67 -40.41 63.71 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 124.054 0.942 . . . . 0.0 110.935 176.343 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 77.2 t60 -66.61 -38.77 87.65 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.3 1.04 . . . . 0.0 111.799 -176.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 78.5 mt -62.79 -17.14 60.66 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.83 0.852 . . . . 0.0 112.91 -175.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 83.0 mtp -67.4 -31.25 71.33 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.432 0.693 . . . . 0.0 111.35 174.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 43.2 t-20 -104.38 -68.58 0.84 Allowed 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.7 m-80 -120.89 169.54 10.35 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 123.359 0.664 . . . . 0.0 111.119 -175.296 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 58.6 mmtt -111.25 10.75 21.74 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.396 0.678 . . . . 0.0 109.887 179.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 61.3 m-20 -85.5 163.88 18.16 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.726 0.811 . . . . 0.0 113.179 -168.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.426 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 42.0 t -92.75 61.14 3.55 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.467 0.707 . . . . 0.0 111.559 -176.698 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 47.37 -81.48 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 125.869 1.668 . . . . 0.0 114.298 164.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 47.7 m-85 -79.05 -46.61 17.77 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.368 1.067 . . . . 0.0 111.057 -170.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 15.5 p -100.18 -7.02 25.25 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 122.596 0.358 . . . . 0.0 111.498 -177.123 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 58.73 21.82 9.32 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 124.845 1.258 . . . . 0.0 113.623 176.149 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 29.5 m -72.91 124.77 26.1 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 174.35 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 28.5 m -60.23 115.8 3.77 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-O 120.907 0.384 . . . . 0.0 110.038 -178.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.449 HG22 HG23 ' A' ' 55' ' ' VAL . 38.7 mt -71.51 125.62 30.34 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 124.126 0.97 . . . . 0.0 110.624 -171.554 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 36.7 t -85.88 -41.47 15.32 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.774 0 C-N-CA 123.227 0.611 . . . . 0.0 109.678 -178.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 48.0 m -147.97 145.44 28.55 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.501 0.721 . . . . 0.0 110.024 178.194 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.449 HG23 HG22 ' A' ' 52' ' ' ILE . 38.3 t -115.11 104.62 17.15 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 175.4 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -88.64 144.48 26.26 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 110.065 -0.346 . . . . 0.0 110.065 179.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -73.8 103.74 4.45 Favored 'General case' 0 C--O 1.238 0.463 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 172.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 53.5 t90 -72.63 94.84 1.77 Allowed 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 178.512 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -84.61 117.23 23.62 Favored 'General case' 0 C--O 1.237 0.442 0 N-CA-C 107.779 -1.193 . . . . 0.0 107.779 173.076 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 10.0 ptpp? -70.85 -17.77 62.72 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.163 0.585 . . . . 0.0 112.376 -172.022 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.954 0 CA-C-O 119.282 -0.732 . . . . 0.0 111.323 177.261 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 36.1 t . . . . . 0 N--CA 1.475 0.781 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 31.1 p80 -89.51 0.53 56.82 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.548 0.739 . . . . 0.0 111.385 177.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 20.3 ptp -113.9 93.42 29.31 Favored Pre-proline 0 CA--C 1.555 1.158 0 C-N-CA 123.48 0.712 . . . . 0.0 111.77 -171.191 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -88.96 -176.05 1.31 Allowed 'Trans proline' 0 C--N 1.377 2.074 0 C-N-CA 122.797 2.332 . . . . 0.0 111.46 169.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 6.6 t -147.84 -44.08 0.16 Allowed 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.0 0.52 . . . . 0.0 110.131 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 15.6 m -102.43 80.37 1.93 Allowed 'General case' 0 C--O 1.239 0.513 0 C-N-CA 123.826 0.85 . . . . 0.0 109.433 -178.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -70.82 94.08 1.02 Allowed 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.691 179.068 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.536 ' H ' ' HG ' ' A' ' 10' ' ' LEU . 40.2 tt0 -118.43 70.98 0.82 Allowed 'General case' 0 C--O 1.244 0.792 0 C-N-CA 123.899 0.88 . . . . 0.0 109.092 -177.859 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.456 ' O ' HG13 ' A' ' 19' ' ' ILE . 4.5 m-20 54.62 32.34 16.91 Favored 'General case' 0 N--CA 1.482 1.148 0 CA-C-N 114.714 -1.13 . . . . 0.0 111.685 -173.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.536 ' HG ' ' H ' ' A' ' 8' ' ' GLU . 48.2 mt -63.87 127.0 29.45 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 122.778 0.431 . . . . 0.0 111.159 -174.768 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 46.4 t -53.07 109.29 1.39 Allowed Pre-proline 0 C--N 1.352 0.685 0 O-C-N 124.375 1.047 . . . . 0.0 109.51 172.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -56.39 -31.05 83.94 Favored 'Trans proline' 0 C--N 1.373 1.832 0 C-N-CA 122.905 2.403 . . . . 0.0 113.376 -172.689 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 55.6 mt -66.56 -39.01 82.86 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.004 0 C-N-CA 124.262 1.025 . . . . 0.0 111.5 -179.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 82.5 m -106.87 -24.87 11.91 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.415 0.686 . . . . 0.0 112.68 -170.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 90.8 m-85 67.27 -60.44 0.37 Allowed 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 126.098 1.759 . . . . 0.0 112.86 -170.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.34 -44.13 92.69 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 114.791 1.404 . . . . 0.0 114.791 -165.241 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 54.4 m170 -104.37 150.84 38.88 Favored Pre-proline 0 N--CA 1.485 1.295 0 C-N-CA 123.179 0.591 . . . . 0.0 109.68 -175.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.525 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 84.0 Cg_endo -75.39 -164.42 0.24 Allowed 'Trans proline' 0 C--N 1.373 1.864 0 C-N-CA 123.049 2.5 . . . . 0.0 113.685 -179.063 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.456 HG13 ' O ' ' A' ' 9' ' ' ASP . 97.4 mt -78.91 131.59 34.05 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.638 173.776 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 38.7 t -128.13 -5.84 5.5 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.188 0.995 . . . . 0.0 110.497 179.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -150.68 158.24 43.92 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.273 0.629 . . . . 0.0 111.309 -176.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.1 p -137.64 122.91 24.85 Favored 'Isoleucine or valine' 0 C--O 1.245 0.828 0 C-N-CA 124.293 1.037 . . . . 0.0 109.016 178.122 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.0 m-30 -75.23 86.09 2.44 Favored 'General case' 0 C--O 1.241 0.606 0 CA-C-N 115.167 -0.924 . . . . 0.0 108.674 178.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 11.4 mt-30 -87.83 146.47 38.96 Favored Pre-proline 0 CA--C 1.543 0.711 0 C-N-CA 122.87 0.468 . . . . 0.0 111.203 -174.513 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_endo -92.17 17.99 40.68 Favored 'Cis proline' 0 C--N 1.371 1.734 0 C-N-CA 124.859 -0.892 . . . . 0.0 114.094 3.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 27.4 t -72.29 -27.5 62.5 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 111.879 0.326 . . . . 0.0 111.879 -173.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 90.74 -16.85 57.21 Favored Glycine 0 C--N 1.347 1.179 0 CA-C-O 119.357 -0.69 . . . . 0.0 114.458 175.246 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 5.9 m80 -61.94 120.06 10.05 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.15 0.58 . . . . 0.0 110.26 175.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 52.5 mttp -110.13 159.47 17.32 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.563 0.697 . . . . 0.0 111.763 -174.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 93.0 p -166.37 -164.57 0.68 Allowed 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 114.183 -1.371 . . . . 0.0 107.894 173.266 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 16.3 p -86.24 154.17 21.47 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 171.015 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -67.55 -28.81 68.11 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.214 0.606 . . . . 0.0 110.239 -175.38 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -56.95 -41.54 78.45 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.766 0.826 . . . . 0.0 112.012 175.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.8 m -55.23 -59.26 5.03 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.511 0.724 . . . . 0.0 110.994 177.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.68 HG21 HG11 ' A' ' 55' ' ' VAL . 10.4 tp -73.79 -22.55 18.67 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.763 0 CA-C-N 115.3 -0.863 . . . . 0.0 111.599 -173.263 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -64.49 -42.26 95.97 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 122.802 0.441 . . . . 0.0 109.853 178.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 22.7 tm0? -74.69 -34.71 62.71 Favored 'General case' 0 CA--C 1.552 1.048 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.41 176.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.502 ' HB3' HD13 ' A' ' 35' ' ' ILE . 41.5 t60 -67.21 -39.93 86.36 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.829 0.852 . . . . 0.0 111.333 -177.69 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 72.7 mt -73.99 -0.89 17.66 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 123.7 0.8 . . . . 0.0 112.82 -177.333 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 64.1 mtt -72.85 -14.31 61.47 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 123.074 0.55 . . . . 0.0 111.245 174.007 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -149.41 -57.58 0.2 Allowed 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.633 0.773 . . . . 0.0 109.621 174.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 36.4 m-20 -79.68 172.59 13.58 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.914 0.886 . . . . 0.0 110.71 -175.086 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -159.69 54.18 0.37 Allowed 'General case' 0 N--CA 1.484 1.227 0 CA-C-O 122.073 0.94 . . . . 0.0 109.204 -176.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -155.14 174.27 15.43 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.21 -172.031 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 96.9 m -70.6 137.17 49.76 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.87 172.36 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 71.0 m-85 -58.43 -36.12 73.15 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-O 121.198 0.523 . . . . 0.0 109.854 167.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -76.91 -75.23 0.21 Allowed 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 124.625 1.17 . . . . 0.0 111.705 -172.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 7.2 p -91.98 -8.25 46.66 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.136 0.575 . . . . 0.0 112.368 -170.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 66.56 18.3 10.76 Favored 'General case' 0 CA--C 1.572 1.803 0 C-N-CA 124.287 1.035 . . . . 0.0 111.786 178.578 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 93.6 m -78.59 129.96 35.38 Favored 'General case' 0 N--CA 1.485 1.304 0 O-C-N 121.479 -0.763 . . . . 0.0 110.593 174.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 31.2 m -59.97 134.44 57.04 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.249 1.02 . . . . 0.0 111.123 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.466 HG22 HG22 ' A' ' 55' ' ' VAL . 22.0 mt -93.24 135.49 27.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 123.355 0.662 . . . . 0.0 109.94 -177.622 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 77.2 t -79.66 -46.37 22.75 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 C-N-CA 123.106 0.562 . . . . 0.0 109.549 174.223 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 47.1 p -160.33 134.71 7.42 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.035 0.534 . . . . 0.0 110.057 179.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.68 HG11 HG21 ' A' ' 35' ' ' ILE . 36.9 t -98.21 105.16 16.88 Favored 'Isoleucine or valine' 0 C--O 1.243 0.762 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 177.807 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -86.06 143.09 28.27 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 176.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -71.3 123.94 23.4 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 172.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 32.4 t90 -71.75 108.34 5.02 Favored 'General case' 0 C--O 1.242 0.698 0 CA-C-O 121.081 0.467 . . . . 0.0 111.102 -171.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -76.85 152.41 35.48 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.475 170.227 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 11.9 mptt -98.51 -16.22 19.26 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.126 0.571 . . . . 0.0 111.022 -174.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.35 0 CA-C-O 118.85 -0.972 . . . . 0.0 113.276 177.577 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 42.4 m . . . . . 0 N--CA 1.491 1.603 0 N-CA-C 110.602 -0.147 . . . . 0.0 110.602 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 13.4 t60 -72.97 86.1 1.29 Allowed 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 176.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 19.7 ptp -159.79 105.31 1.44 Allowed Pre-proline 0 CA--C 1.548 0.89 0 C-N-CA 124.22 1.008 . . . . 0.0 108.999 178.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -62.79 101.31 0.26 Allowed 'Trans proline' 0 C--N 1.378 2.118 0 C-N-CA 122.631 2.22 . . . . 0.0 111.479 174.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 5.7 t -163.83 -30.74 0.04 OUTLIER 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 124.075 0.95 . . . . 0.0 110.487 177.527 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 40.3 m 66.62 93.2 0.07 Allowed 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 124.541 1.136 . . . . 0.0 111.435 175.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -81.56 152.5 27.21 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.604 0.762 . . . . 0.0 110.666 179.278 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -99.65 56.2 0.98 Allowed 'General case' 0 N--CA 1.484 1.263 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 171.386 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 33.8 t70 58.64 57.82 3.58 Favored 'General case' 0 N--CA 1.479 1.011 0 CA-C-O 122.673 1.225 . . . . 0.0 110.458 -175.017 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.425 HD12 ' O ' ' A' ' 15' ' ' TYR . 75.2 mt -79.79 162.24 25.22 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 114.488 -1.233 . . . . 0.0 109.612 174.8 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 52.4 t -55.04 120.75 31.54 Favored Pre-proline 0 CA--C 1.555 1.155 0 CA-C-O 118.71 -0.662 . . . . 0.0 111.241 -177.263 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -58.1 -27.76 81.09 Favored 'Trans proline' 0 C--N 1.387 2.569 0 C-N-CA 123.236 2.624 . . . . 0.0 113.248 -172.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.5 mp -77.49 -47.15 26.76 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.939 0 CA-C-N 114.642 -1.163 . . . . 0.0 110.331 179.09 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 74.3 m -95.61 -59.15 1.93 Allowed 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.354 0.661 . . . . 0.0 111.85 -166.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.425 ' O ' HD12 ' A' ' 10' ' ' LEU . 22.6 m-85 75.19 -39.37 0.4 Allowed 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 125.72 1.608 . . . . 0.0 113.09 -172.865 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.57 -8.43 53.98 Favored 'General case' 0 N--CA 1.486 1.341 0 CA-C-N 118.812 0.733 . . . . 0.0 112.339 -179.213 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 70.0 m80 -142.09 153.54 63.69 Favored Pre-proline 0 CA--C 1.555 1.161 0 C-N-CA 124.003 0.921 . . . . 0.0 108.639 175.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -79.09 -159.63 0.11 Allowed 'Trans proline' 0 C--N 1.382 2.335 0 C-N-CA 123.289 2.659 . . . . 0.0 113.421 -177.112 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.413 HG23 ' HB3' ' A' ' 29' ' ' LYS . 53.7 mt -98.87 133.52 41.15 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 C-N-CA 124.188 0.995 . . . . 0.0 110.095 176.415 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 50.1 m -137.4 18.0 2.93 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.196 0.998 . . . . 0.0 110.593 -179.491 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.413 ' HA ' ' O ' ' A' ' 56' ' ' GLU . . . -154.09 141.03 19.25 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.182 0.593 . . . . 0.0 110.747 -176.359 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 6.9 p -123.51 133.21 69.81 Favored 'Isoleucine or valine' 0 C--O 1.241 0.607 0 C-N-CA 123.522 0.729 . . . . 0.0 109.208 173.626 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -86.96 91.24 8.62 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-N 115.182 -0.917 . . . . 0.0 108.606 -179.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -83.07 141.99 43.93 Favored Pre-proline 0 CA--C 1.552 1.023 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.389 -171.36 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_endo -97.49 23.62 23.46 Favored 'Cis proline' 0 C--N 1.377 2.031 0 CA-C-N 119.369 0.81 . . . . 0.0 113.2 -1.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 43.0 t -63.34 -55.4 24.86 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.313 0.645 . . . . 0.0 111.757 -176.101 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 117.09 -25.31 8.87 Favored Glycine 0 C--N 1.345 1.074 0 CA-C-O 119.351 -0.694 . . . . 0.0 113.681 -179.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.431 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 19.9 m170 -58.64 141.53 52.16 Favored 'General case' 0 N--CA 1.484 1.256 0 CA-C-N 117.43 0.615 . . . . 0.0 109.566 172.087 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.413 ' HB3' HG23 ' A' ' 19' ' ' ILE . 53.9 mttp -132.63 165.09 25.23 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.004 0.522 . . . . 0.0 110.747 -174.389 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 42.9 t -172.18 -179.87 2.43 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.258 1.423 . . . . 0.0 107.909 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 13.9 p -78.24 150.13 33.5 Favored 'General case' 0 C--O 1.245 0.848 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 171.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -60.6 -38.12 83.63 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 122.922 0.489 . . . . 0.0 111.827 -175.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.41 -32.05 69.82 Favored 'General case' 0 CA--C 1.554 1.133 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -176.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.1 m -61.33 -58.43 8.28 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 123.454 0.702 . . . . 0.0 111.139 172.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.534 HG23 HG11 ' A' ' 55' ' ' VAL . 7.0 tp -69.37 -30.4 45.62 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 O-C-N 123.285 0.366 . . . . 0.0 111.295 -173.009 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 61.0 t30 -63.38 -45.7 89.9 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 175.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -65.79 -33.57 76.16 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.853 0.861 . . . . 0.0 110.509 175.018 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.429 ' HA ' HD21 ' A' ' 41' ' ' ASN . 69.9 t60 -71.42 -32.78 68.78 Favored 'General case' 0 C--O 1.217 -0.644 0 C-N-CA 123.584 0.753 . . . . 0.0 110.372 -179.342 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 90.9 mt -66.61 -9.57 36.84 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 123.629 0.772 . . . . 0.0 111.913 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 82.2 mtp -76.69 -41.74 44.24 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 122.979 0.512 . . . . 0.0 109.732 168.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.429 HD21 ' HA ' ' A' ' 38' ' ' HIS . 23.4 m-80 -76.09 -70.41 0.44 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.039 0.935 . . . . 0.0 110.294 179.412 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 -143.87 167.39 22.44 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 125.121 1.368 . . . . 0.0 109.271 -177.242 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -98.33 21.2 11.35 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-O 121.813 0.816 . . . . 0.0 110.31 175.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -90.37 166.26 13.39 Favored 'General case' 0 CA--C 1.545 0.75 0 CA-C-O 121.811 0.815 . . . . 0.0 112.778 -173.066 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.431 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 43.6 t -96.02 54.35 1.46 Allowed 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 115.287 -0.87 . . . . 0.0 111.245 -171.662 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 49.68 -84.61 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 125.777 1.631 . . . . 0.0 113.649 174.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 40.3 m-85 -74.73 -65.4 0.87 Allowed 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.605 1.162 . . . . 0.0 109.937 -169.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 14.0 p -75.07 -17.08 60.53 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 122.535 0.334 . . . . 0.0 111.215 -177.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 52.1 mttp 65.34 23.56 12.07 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 125.299 1.44 . . . . 0.0 113.372 176.329 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 36.2 m -69.09 128.31 36.2 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 122.563 0.345 . . . . 0.0 110.173 174.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 18.0 m -62.27 110.68 1.71 Allowed 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 176.303 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 42.0 mt -70.98 135.14 28.68 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 124.131 0.972 . . . . 0.0 110.977 -172.604 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 60.1 t -78.19 -51.76 17.08 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 C-N-CA 122.97 0.508 . . . . 0.0 109.701 177.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 50.3 m -149.91 151.51 33.53 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 -179.127 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.534 HG11 HG23 ' A' ' 35' ' ' ILE . 47.6 t -121.23 110.21 27.31 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.11 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 177.674 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.413 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 1.6 mp0 -92.91 154.59 18.11 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 122.909 0.484 . . . . 0.0 110.785 179.517 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -67.63 96.6 0.55 Allowed 'General case' 0 C--O 1.241 0.631 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 168.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 52.9 t90 -75.79 91.65 2.97 Favored 'General case' 0 C--O 1.238 0.454 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 176.581 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -95.05 112.23 23.96 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 114.575 -1.193 . . . . 0.0 109.167 177.305 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 63.1 pttt -76.65 -18.75 58.4 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.997 0.919 . . . . 0.0 110.524 176.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.153 0 CA-C-O 118.759 -1.023 . . . . 0.0 111.343 -179.577 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 38.6 t . . . . . 0 N--CA 1.48 1.026 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 75.5 t60 -167.4 93.87 0.43 Allowed 'General case' 0 C--N 1.356 0.864 0 C-N-CA 123.259 0.623 . . . . 0.0 109.42 -179.134 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 61.2 mtt 59.33 92.6 0.06 OUTLIER Pre-proline 0 N--CA 1.486 1.351 0 C-N-CA 124.692 1.197 . . . . 0.0 111.199 178.53 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -73.42 88.25 1.02 Allowed 'Trans proline' 0 C--N 1.379 2.137 0 C-N-CA 122.853 2.369 . . . . 0.0 111.371 -171.282 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 6.3 t 47.12 25.58 0.54 Allowed 'General case' 0 N--CA 1.495 1.821 0 C-N-CA 126.087 1.755 . . . . 0.0 113.032 -178.567 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 25.7 p -69.76 148.44 49.16 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.843 0.857 . . . . 0.0 111.868 -170.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -73.6 147.62 43.68 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.52 179.765 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -79.51 -1.36 37.27 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.206 0.602 . . . . 0.0 111.096 175.656 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -77.86 19.68 0.39 Allowed 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 124.773 1.229 . . . . 0.0 111.84 178.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.638 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 79.4 mt -60.13 140.47 56.89 Favored 'General case' 0 C--N 1.349 0.575 0 C-N-CA 123.803 0.841 . . . . 0.0 111.497 178.289 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 46.0 t -59.82 119.15 38.4 Favored Pre-proline 0 CA--C 1.545 0.781 0 CA-C-O 118.208 -0.901 . . . . 0.0 108.773 172.122 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -59.81 -28.17 86.61 Favored 'Trans proline' 0 C--N 1.374 1.92 0 C-N-CA 122.586 2.191 . . . . 0.0 112.39 -175.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 69.6 mt -72.05 -32.61 44.36 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.099 0 C-N-CA 124.758 1.223 . . . . 0.0 112.201 -179.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 79.0 m -118.37 -50.61 2.44 Favored 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -167.091 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 80.39 -42.42 0.22 Allowed 'General case' 0 N--CA 1.498 1.946 0 C-N-CA 126.594 1.958 . . . . 0.0 112.445 -179.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.95 -33.32 71.76 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.444 0.698 . . . . 0.0 112.606 -176.343 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 11.6 m170 -125.14 155.33 71.2 Favored Pre-proline 0 N--CA 1.485 1.289 0 C-N-CA 124.099 0.96 . . . . 0.0 109.196 -179.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.638 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 95.0 Cg_endo -75.64 -163.51 0.2 Allowed 'Trans proline' 0 C--N 1.38 2.224 0 C-N-CA 122.914 2.41 . . . . 0.0 113.401 -176.332 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 86.8 mt -89.11 142.72 12.48 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 C-N-CA 123.833 0.853 . . . . 0.0 108.869 171.275 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 39.7 t -129.2 -16.73 3.95 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.479 0.712 . . . . 0.0 110.785 178.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -145.58 133.02 20.72 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -168.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.6 p -102.5 143.07 15.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 124.892 1.277 . . . . 0.0 109.542 169.409 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 18.5 m-85 -99.13 85.62 3.27 Favored 'General case' 0 C--O 1.242 0.674 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 176.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.486 ' NE2' ' HG3' ' A' ' 56' ' ' GLU . 10.1 tt0 -82.77 143.44 46.73 Favored Pre-proline 0 CA--C 1.553 1.088 0 CA-C-N 114.157 -1.383 . . . . 0.0 108.944 -174.096 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -92.41 13.64 50.37 Favored 'Cis proline' 0 C--N 1.386 2.524 0 N-CA-C 115.925 1.471 . . . . 0.0 115.925 1.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 50.8 t -62.03 -53.78 50.8 Favored 'General case' 0 N--CA 1.484 1.251 0 CA-C-N 118.55 0.614 . . . . 0.0 111.798 -177.546 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 129.43 -43.05 1.35 Allowed Glycine 0 C--N 1.347 1.176 0 CA-C-O 119.15 -0.806 . . . . 0.0 113.297 177.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.647 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 34.5 m80 -52.16 136.01 30.79 Favored 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 123.426 0.69 . . . . 0.0 112.572 -177.361 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 6.2 mptt -118.49 168.88 10.26 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.514 0.726 . . . . 0.0 110.997 178.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 96.9 p -170.2 -176.07 2.14 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.068 1.347 . . . . 0.0 107.738 171.057 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 17.8 p -72.63 146.69 46.43 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 168.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 35.2 ttpt -70.31 -16.87 63.05 Favored 'General case' 0 N--CA 1.483 1.213 0 CA-C-O 121.079 0.466 . . . . 0.0 110.882 -175.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.91 -39.94 91.23 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 123.646 0.779 . . . . 0.0 111.299 170.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.5 m -56.42 -52.42 64.72 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.761 0.824 . . . . 0.0 111.297 178.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.444 HD11 HG13 ' A' ' 52' ' ' ILE . 9.7 tp -71.36 -32.78 47.89 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 O-C-N 123.398 0.436 . . . . 0.0 111.04 -174.753 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -59.13 -47.96 83.36 Favored 'General case' 0 N--CA 1.484 1.242 0 CA-C-O 121.104 0.478 . . . . 0.0 110.237 173.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -73.3 -21.61 60.54 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 115.035 -0.984 . . . . 0.0 111.699 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 46.7 t60 -77.66 -37.43 49.87 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.557 0.743 . . . . 0.0 110.163 177.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 96.1 mt -73.77 0.73 12.19 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 124.025 0.93 . . . . 0.0 111.648 179.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 23.5 mmt -78.8 -14.94 58.98 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 124.134 0.973 . . . . 0.0 110.408 169.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -134.83 -70.42 0.5 Allowed 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 123.855 0.862 . . . . 0.0 109.854 179.185 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -102.25 -174.83 2.67 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 124.064 0.946 . . . . 0.0 111.873 -174.058 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -144.93 64.82 1.28 Allowed 'General case' 0 C--N 1.349 0.587 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 175.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.452 ' HB3' ' HA ' ' A' ' 49' ' ' LYS . 18.5 m-20 -137.65 159.93 40.6 Favored 'General case' 0 N--CA 1.483 1.202 0 CA-C-O 121.736 0.779 . . . . 0.0 111.295 -169.436 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.647 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 21.8 t -94.51 37.0 1.13 Allowed 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 124.891 1.276 . . . . 0.0 111.194 -172.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 58.65 -86.32 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 125.04 1.336 . . . . 0.0 113.65 169.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 -87.66 44.71 1.21 Allowed 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 124.871 1.268 . . . . 0.0 112.664 -167.044 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 23.5 p 175.8 -31.96 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 126.093 1.757 . . . . 0.0 107.885 -178.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.452 ' HA ' ' HB3' ' A' ' 44' ' ' ASP . 9.9 mtmp? 63.1 38.65 10.61 Favored 'General case' 0 C--N 1.365 1.258 0 C-N-CA 125.301 1.441 . . . . 0.0 111.999 -178.017 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 8.0 m -71.97 129.21 38.0 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 166.664 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 47.9 m -57.09 131.99 51.57 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 123.093 0.557 . . . . 0.0 110.551 178.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.444 HG13 HD11 ' A' ' 35' ' ' ILE . 38.0 mm -63.09 113.43 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 123.083 0.553 . . . . 0.0 111.051 -175.118 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 75.1 t -77.13 -56.76 7.14 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 170.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 62.6 m -153.21 136.17 15.48 Favored 'General case' 0 C--O 1.246 0.903 0 C-N-CA 123.312 0.645 . . . . 0.0 111.073 177.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 59.9 t -95.26 105.01 16.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 123.973 0.909 . . . . 0.0 108.667 170.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.486 ' HG3' ' NE2' ' A' ' 24' ' ' GLN . 23.6 mm-40 -97.26 146.75 24.82 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 172.649 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -75.29 112.17 11.31 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 172.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 57.7 t90 -75.25 133.4 41.37 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 123.415 0.686 . . . . 0.0 111.218 -174.136 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -106.14 132.02 52.7 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.941 0.897 . . . . 0.0 109.042 176.038 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -81.81 106.24 13.58 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-O 120.979 0.419 . . . . 0.0 110.235 176.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.115 0 N-CA-C 110.446 -1.062 . . . . 0.0 110.446 177.272 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 21.7 m . . . . . 0 N--CA 1.479 0.982 0 CA-C-O 120.286 0.089 . . . . 0.0 110.908 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 73.4 m80 -80.38 167.1 20.63 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 123.197 0.599 . . . . 0.0 111.651 -179.204 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.429 ' HA ' ' HD3' ' A' ' 4' ' ' PRO . 88.2 mtp -83.62 130.12 57.1 Favored Pre-proline 0 CA--C 1.55 0.956 0 C-N-CA 123.464 0.706 . . . . 0.0 110.074 176.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.429 ' HD3' ' HA ' ' A' ' 3' ' ' MET . 31.4 Cg_exo -61.66 -19.46 65.15 Favored 'Trans proline' 0 C--N 1.384 2.444 0 C-N-CA 123.494 2.796 . . . . 0.0 114.684 -175.606 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 25.3 m 70.25 159.95 0.2 Allowed 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.565 1.146 . . . . 0.0 110.618 -177.539 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 12.3 p -57.38 135.99 56.57 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.189 0.596 . . . . 0.0 110.465 171.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -68.23 -56.0 10.24 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.388 0.675 . . . . 0.0 111.546 -172.138 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.728 ' HB2' ' HG ' ' A' ' 10' ' ' LEU . 39.8 mt-10 53.39 -152.1 0.31 Allowed 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 124.6 1.16 . . . . 0.0 111.564 175.156 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -96.3 27.55 3.68 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.296 0.638 . . . . 0.0 109.805 167.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.728 ' HG ' ' HB2' ' A' ' 8' ' ' GLU . 85.1 mt -68.05 145.0 54.85 Favored 'General case' 0 C--N 1.352 0.68 0 C-N-CA 123.223 0.609 . . . . 0.0 111.197 -178.826 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 41.2 t -60.32 118.66 35.65 Favored Pre-proline 0 CA--C 1.545 0.77 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.486 173.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -65.92 -15.16 47.8 Favored 'Trans proline' 0 N--CA 1.5 1.877 0 C-N-CA 122.549 2.166 . . . . 0.0 113.013 -174.352 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 43.8 mt -85.96 -20.06 8.15 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.205 0 C-N-CA 124.478 1.111 . . . . 0.0 111.034 -178.462 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 39.8 m -134.39 -51.62 0.81 Allowed 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -169.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 78.95 -40.08 0.24 Allowed 'General case' 0 N--CA 1.498 1.954 0 C-N-CA 126.194 1.798 . . . . 0.0 112.981 -178.345 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.18 -14.66 56.73 Favored 'General case' 0 CA--C 1.559 1.3 0 N-CA-C 113.121 0.786 . . . . 0.0 113.121 -177.083 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 57.7 m-70 -137.77 150.36 67.6 Favored Pre-proline 0 N--CA 1.485 1.288 0 C-N-CA 124.049 0.94 . . . . 0.0 109.458 172.123 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.662 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 87.6 Cg_endo -76.02 -165.7 0.32 Allowed 'Trans proline' 0 C--N 1.382 2.341 0 C-N-CA 123.144 2.563 . . . . 0.0 113.762 178.107 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 65.9 mt -78.29 149.28 5.83 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.93 0 C-N-CA 123.448 0.699 . . . . 0.0 110.445 175.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.6 m -136.13 -32.65 0.86 Allowed 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.628 0.771 . . . . 0.0 111.079 -179.213 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -130.21 152.9 49.14 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.547 0.739 . . . . 0.0 111.584 -170.26 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.43 HG12 HE22 ' A' ' 24' ' ' GLN . 7.2 p -128.53 138.69 53.94 Favored 'Isoleucine or valine' 0 C--O 1.244 0.771 0 C-N-CA 124.828 1.251 . . . . 0.0 108.29 176.066 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 19.0 m-85 -107.27 105.62 15.68 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.094 0.558 . . . . 0.0 110.782 -169.305 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.43 HE22 HG12 ' A' ' 22' ' ' VAL . 2.9 mp0 -82.6 149.37 60.57 Favored Pre-proline 0 N--CA 1.474 0.735 0 C-N-CA 123.976 0.91 . . . . 0.0 110.469 174.804 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -97.15 81.64 0.13 OUTLIER 'Cis proline' 0 C--N 1.369 1.619 0 CA-C-N 118.853 0.626 . . . . 0.0 110.871 -3.304 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 36.6 t -143.11 -64.52 0.4 Allowed 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.861 -0.609 . . . . 0.0 112.127 -175.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 114.96 -12.03 20.28 Favored Glycine 0 C--N 1.345 1.032 0 CA-C-O 118.884 -0.953 . . . . 0.0 113.79 -176.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.414 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 6.1 m170 -58.31 139.42 55.25 Favored 'General case' 0 N--CA 1.491 1.606 0 CA-C-N 118.17 0.985 . . . . 0.0 110.207 171.541 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 57.4 mttp -130.41 156.28 45.0 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.318 0.647 . . . . 0.0 110.729 -174.136 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 92.9 p -169.0 -179.39 3.62 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.27 1.028 . . . . 0.0 109.11 174.028 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 13.6 p -69.04 148.91 49.37 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 173.331 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -71.03 -18.16 62.59 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-N 117.859 0.3 . . . . 0.0 111.667 -174.53 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.17 -34.38 74.95 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 122.369 0.268 . . . . 0.0 111.47 171.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.7 m -60.86 -51.72 68.11 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.496 0.718 . . . . 0.0 111.243 177.223 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.416 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 10.0 tp -71.33 -31.81 44.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 O-C-N 123.236 0.335 . . . . 0.0 110.849 -176.67 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 4.7 t30 -60.93 -46.49 90.46 Favored 'General case' 0 N--CA 1.48 1.05 0 CA-C-O 121.288 0.566 . . . . 0.0 109.967 174.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 63.7 tt0 -72.09 -27.12 62.45 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.083 178.537 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 47.3 t60 -77.17 -39.24 49.7 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 122.802 0.441 . . . . 0.0 110.674 -177.777 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.416 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 69.6 mt -66.33 -25.44 66.82 Favored 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 112.828 0.677 . . . . 0.0 112.828 -173.276 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 26.6 ptm -75.19 -14.15 60.52 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 122.541 0.336 . . . . 0.0 111.482 175.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 46.1 m-80 -105.87 -67.22 0.94 Allowed 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.203 0.601 . . . . 0.0 110.401 175.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 41.5 m-80 -132.17 -168.37 2.03 Favored 'General case' 0 N--CA 1.49 1.537 0 C-N-CA 124.871 1.268 . . . . 0.0 110.75 -176.054 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 82.4 tttt -135.62 9.41 3.38 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 123.389 0.675 . . . . 0.0 110.776 176.55 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.408 ' HB2' ' HA ' ' A' ' 49' ' ' LYS . 3.7 p30 -74.64 167.61 21.44 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-O 121.336 0.588 . . . . 0.0 111.372 -179.444 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.429 ' HA ' HD13 ' A' ' 52' ' ' ILE . 53.5 t -90.24 52.75 2.31 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.561 0.744 . . . . 0.0 110.877 -177.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 35.6 m-85 54.97 -80.25 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 126.084 1.754 . . . . 0.0 113.262 172.644 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 48.8 m-85 -83.58 -62.69 1.51 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.334 1.054 . . . . 0.0 110.732 -172.214 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 9.4 p -80.34 -7.95 59.29 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 122.829 0.451 . . . . 0.0 111.959 -173.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.408 ' HA ' ' HB2' ' A' ' 44' ' ' ASP . 74.4 mmtt 67.99 11.52 8.4 Favored 'General case' 0 N--CA 1.484 1.27 0 N-CA-C 114.583 1.327 . . . . 0.0 114.583 172.686 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 39.3 m -64.12 136.35 57.18 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 122.886 0.474 . . . . 0.0 111.025 176.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 90.0 m -63.06 119.91 10.42 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 122.861 0.464 . . . . 0.0 110.305 176.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.429 HD13 ' HA ' ' A' ' 45' ' ' CYS . 53.3 mt -79.13 104.29 6.96 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.797 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 -178.531 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 88.0 t -75.05 -31.38 24.85 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.818 0 C-N-CA 123.722 0.809 . . . . 0.0 110.735 177.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.3 t -151.7 134.18 15.39 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-O 120.678 0.275 . . . . 0.0 111.036 179.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 59.3 t -105.11 103.42 15.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 171.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -109.28 146.04 34.94 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.094 0.558 . . . . 0.0 110.556 -175.317 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -72.09 106.69 4.43 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.239 0.616 . . . . 0.0 110.347 -177.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 60.3 t90 -81.12 112.49 18.53 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 176.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -107.66 119.57 39.8 Favored 'General case' 0 C--O 1.239 0.55 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 174.651 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -70.48 -47.89 58.38 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.165 0.507 . . . . 0.0 110.23 -178.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.85 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.772 -177.733 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 43.2 m . . . . . 0 N--CA 1.487 1.39 0 CA-C-O 120.286 0.089 . . . . 0.0 110.869 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 65.9 m-70 60.31 91.38 0.05 Allowed 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.869 1.268 . . . . 0.0 111.428 -177.478 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 38.9 mtm -80.18 120.65 80.27 Favored Pre-proline 0 CA--C 1.55 0.975 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 174.105 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_exo -67.37 147.72 78.32 Favored 'Trans proline' 0 C--N 1.376 1.981 0 C-N-CA 122.339 2.026 . . . . 0.0 112.043 178.117 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.7 m 69.63 13.82 8.21 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 124.943 1.297 . . . . 0.0 111.621 178.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 68.5 m -76.81 -47.72 20.65 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 122.907 0.483 . . . . 0.0 109.748 174.043 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 56.92 -164.43 0.16 Allowed 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 124.469 1.108 . . . . 0.0 111.816 174.44 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.69 ' HB3' ' HG ' ' A' ' 10' ' ' LEU . 7.8 tp10 66.81 176.32 0.24 Allowed 'General case' 0 CA--C 1.56 1.353 0 C-N-CA 124.077 0.951 . . . . 0.0 111.312 172.41 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -83.28 39.2 0.64 Allowed 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.306 0.642 . . . . 0.0 110.448 169.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.69 ' HG ' ' HB3' ' A' ' 8' ' ' GLU . 63.1 mt -59.65 120.95 10.43 Favored 'General case' 0 C--N 1.354 0.803 0 C-N-CA 123.012 0.525 . . . . 0.0 110.755 -179.259 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.561 ' SG ' ' HB2' ' A' ' 30' ' ' SER . 43.0 t -47.38 112.0 1.87 Allowed Pre-proline 0 N--CA 1.476 0.857 0 C-N-CA 125.291 1.436 . . . . 0.0 110.617 -177.009 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -60.25 -16.66 41.98 Favored 'Trans proline' 0 N--CA 1.506 2.264 0 C-N-CA 123.041 2.494 . . . . 0.0 114.085 -169.137 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 68.4 mt -81.26 -43.13 20.27 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.108 0 C-N-CA 124.052 0.941 . . . . 0.0 110.787 177.16 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 93.1 m -97.69 -41.87 7.9 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 123.864 0.866 . . . . 0.0 112.498 -168.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 75.48 -46.45 0.57 Allowed 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 126.756 2.022 . . . . 0.0 112.333 -176.113 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.05 -37.38 87.38 Favored 'General case' 0 N--CA 1.484 1.256 0 N-CA-C 113.75 1.018 . . . . 0.0 113.75 -173.376 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 44.5 m170 -121.44 152.82 58.52 Favored Pre-proline 0 N--CA 1.484 1.26 0 C-N-CA 123.479 0.711 . . . . 0.0 109.521 -177.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.651 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 49.4 Cg_endo -82.4 -170.28 0.91 Allowed 'Trans proline' 0 C--N 1.379 2.151 0 C-N-CA 123.138 2.559 . . . . 0.0 114.243 -175.273 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 88.8 mt -81.38 140.24 16.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 123.674 0.79 . . . . 0.0 109.965 178.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.0 m -140.64 3.85 1.9 Allowed 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.224 0.61 . . . . 0.0 111.276 -177.104 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -152.92 157.27 40.39 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.116 0.566 . . . . 0.0 112.199 -171.131 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.9 p -135.06 140.27 45.57 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 C-N-CA 124.301 1.041 . . . . 0.0 109.185 174.249 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -99.94 99.45 10.22 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.79 0.836 . . . . 0.0 110.704 -173.459 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -72.59 146.94 89.15 Favored Pre-proline 0 N--CA 1.481 1.109 0 C-N-CA 123.845 0.858 . . . . 0.0 111.559 173.303 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 15.8 Cg_endo -95.24 28.41 17.22 Favored 'Cis proline' 0 C--N 1.377 2.027 0 C-N-CA 125.561 -0.6 . . . . 0.0 112.022 -3.621 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 36.9 t -81.36 -74.81 0.31 Allowed 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.447 0.699 . . . . 0.0 111.611 -176.041 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 136.2 -21.93 3.44 Favored Glycine 0 C--N 1.351 1.381 0 CA-C-O 119.362 -0.688 . . . . 0.0 113.927 -177.31 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.411 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 13.4 m170 -58.93 142.83 49.79 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 123.077 0.551 . . . . 0.0 111.174 178.632 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 53.7 mttm -129.35 145.64 51.35 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.62 0.768 . . . . 0.0 110.817 -169.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.561 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 96.0 p -165.65 -177.3 4.29 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.51 1.124 . . . . 0.0 108.389 173.572 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 14.1 p -66.25 142.83 57.55 Favored 'General case' 0 N--CA 1.478 0.935 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 172.17 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -62.69 -29.88 70.98 Favored 'General case' 0 N--CA 1.487 1.381 0 CA-C-N 117.888 0.313 . . . . 0.0 111.57 -177.288 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -53.85 -30.52 45.82 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.419 1.088 . . . . 0.0 112.633 176.272 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.3 m -59.28 -56.87 16.56 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.702 0.801 . . . . 0.0 111.11 175.758 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.555 HG21 HG12 ' A' ' 55' ' ' VAL . 8.3 tp -76.53 -21.71 15.09 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.68 0 O-C-N 123.351 0.407 . . . . 0.0 110.918 -174.725 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -66.03 -41.78 90.46 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 173.305 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -69.97 -40.78 75.17 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.397 0.679 . . . . 0.0 110.623 173.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.443 ' HB3' HD13 ' A' ' 35' ' ' ILE . 78.5 t60 -70.79 -34.32 71.66 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.97 -172.691 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 54.3 mt -71.06 -10.94 60.61 Favored 'General case' 0 N--CA 1.494 1.749 0 CA-C-N 118.364 0.529 . . . . 0.0 112.277 179.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 52.8 mtt -77.18 -17.4 58.58 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.381 0.673 . . . . 0.0 110.227 170.568 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 30.1 t30 -112.28 -75.12 0.61 Allowed 'General case' 0 CA--C 1.558 1.284 0 C-N-CA 124.929 1.292 . . . . 0.0 110.388 179.338 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -127.27 173.65 9.58 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 124.246 1.018 . . . . 0.0 110.961 -176.785 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -112.04 18.59 18.61 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 122.905 0.482 . . . . 0.0 111.556 -176.65 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -96.16 165.71 12.1 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-O 121.4 0.619 . . . . 0.0 112.595 -169.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.411 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 53.2 t -94.62 46.05 1.13 Allowed 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.791 0.836 . . . . 0.0 111.69 -174.843 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 77.5 m-85 54.19 -82.9 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 125.908 1.683 . . . . 0.0 113.54 172.524 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -71.49 -63.12 1.18 Allowed 'General case' 0 C--N 1.348 0.51 0 C-N-CA 124.32 1.048 . . . . 0.0 110.436 -171.726 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 14.6 p -79.74 -14.54 58.65 Favored 'General case' 0 N--CA 1.484 1.233 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.282 -176.254 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 88.8 mttt 64.31 14.98 9.14 Favored 'General case' 0 N--CA 1.494 1.74 0 C-N-CA 124.996 1.318 . . . . 0.0 113.518 175.681 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 16.8 m -67.77 121.91 16.97 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 174.668 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 35.2 m -62.72 117.37 6.21 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-O 121.198 0.523 . . . . 0.0 110.187 -179.102 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 57.9 mt -72.46 129.88 35.63 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 C-N-CA 124.669 1.188 . . . . 0.0 111.132 -173.282 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 76.3 t -79.62 -55.39 9.33 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 172.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.9 m -137.54 144.91 42.34 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.396 0.678 . . . . 0.0 110.284 -173.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.555 HG12 HG21 ' A' ' 35' ' ' ILE . 56.1 t -117.05 119.07 60.85 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 N-CA-C 108.493 -0.928 . . . . 0.0 108.493 171.389 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -99.92 168.32 9.95 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 122.999 0.52 . . . . 0.0 110.525 174.362 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -93.69 101.03 13.15 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 174.223 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 29.8 t90 -73.22 109.62 6.89 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-O 120.87 0.367 . . . . 0.0 110.955 -174.092 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -74.08 148.89 41.47 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.114 0.965 . . . . 0.0 109.339 171.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.42 178.71 5.34 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.287 1.035 . . . . 0.0 109.882 -171.691 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.256 1.51 0 CA-C-O 118.812 -0.993 . . . . 0.0 112.454 176.644 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 20.3 m . . . . . 0 N--CA 1.47 0.567 0 N-CA-C 111.202 0.075 . . . . 0.0 111.202 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -137.16 142.34 42.21 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.96 0.904 . . . . 0.0 109.876 -178.746 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 57.3 ttm -99.15 134.57 21.24 Favored Pre-proline 0 N--CA 1.48 1.074 0 C-N-CA 123.892 0.877 . . . . 0.0 108.991 176.641 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -56.21 103.3 0.11 Allowed 'Trans proline' 0 C--N 1.387 2.57 0 C-N-CA 122.891 2.394 . . . . 0.0 111.96 176.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 26.8 p -77.24 83.57 3.71 Favored 'General case' 0 CA--C 1.547 0.855 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.37 -175.314 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.547 ' HB3' HD12 ' A' ' 10' ' ' LEU . 52.7 m -82.83 126.53 32.54 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 115.052 -0.976 . . . . 0.0 110.014 178.281 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -95.94 33.55 1.68 Allowed 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 124.009 0.923 . . . . 0.0 111.005 -175.053 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -153.06 167.32 29.61 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.806 0.842 . . . . 0.0 109.22 -175.27 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -79.83 58.29 2.8 Favored 'General case' 0 N--CA 1.485 1.301 0 CA-C-O 122.704 1.24 . . . . 0.0 111.177 176.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.547 HD12 ' HB3' ' A' ' 6' ' ' SER . 81.4 mt -82.6 171.95 13.49 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-N 114.618 -1.174 . . . . 0.0 109.634 174.721 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.437 ' SG ' ' HB2' ' A' ' 30' ' ' SER . 51.9 t -56.52 112.57 4.63 Favored Pre-proline 0 N--CA 1.484 1.251 0 CA-C-O 118.74 -0.647 . . . . 0.0 110.079 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -61.08 -17.18 50.53 Favored 'Trans proline' 0 C--N 1.377 2.078 0 C-N-CA 123.307 2.671 . . . . 0.0 113.375 -172.257 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 68.9 mt -84.55 -48.45 16.71 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.064 0 C-N-CA 124.031 0.932 . . . . 0.0 110.906 176.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 90.1 m -86.41 -53.24 5.12 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.152 0.581 . . . . 0.0 111.801 -171.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 78.39 -40.32 0.28 Allowed 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 126.515 1.926 . . . . 0.0 112.329 -175.303 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -78.0 -10.71 59.73 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 113.093 0.775 . . . . 0.0 113.093 -176.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -139.96 154.31 70.4 Favored Pre-proline 0 N--CA 1.483 1.206 0 C-N-CA 123.851 0.86 . . . . 0.0 109.383 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.518 ' HB2' ' HG3' ' A' ' 60' ' ' LYS . 82.0 Cg_endo -77.15 -173.69 1.89 Allowed 'Trans proline' 0 C--N 1.38 2.192 0 C-N-CA 123.045 2.497 . . . . 0.0 114.232 -174.334 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.47 HG22 ' HB3' ' A' ' 29' ' ' LYS . 67.5 mt -89.27 143.33 11.39 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.807 0 CA-C-N 114.767 -1.106 . . . . 0.0 109.659 175.586 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 78.4 p -150.13 19.73 0.87 Allowed 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.134 0.573 . . . . 0.0 111.195 179.683 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -158.38 138.42 12.27 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.477 0.711 . . . . 0.0 110.704 -178.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 10.5 p -116.69 139.93 41.36 Favored 'Isoleucine or valine' 0 C--O 1.245 0.824 0 C-N-CA 124.096 0.958 . . . . 0.0 109.213 171.069 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 15.0 m-85 -97.46 86.7 3.93 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 176.733 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.519 ' HG3' ' HA ' ' A' ' 25' ' ' PRO . 8.5 tt0 -91.21 140.98 25.87 Favored Pre-proline 0 CA--C 1.553 1.084 0 N-CA-C 108.358 -0.978 . . . . 0.0 108.358 -173.893 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.519 ' HA ' ' HG3' ' A' ' 24' ' ' GLN . 12.0 Cg_endo -94.09 22.82 28.16 Favored 'Cis proline' 0 C--N 1.387 2.583 0 N-CA-C 116.246 1.595 . . . . 0.0 116.246 7.609 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 35.3 t -68.52 -63.91 0.97 Allowed 'General case' 0 N--CA 1.481 1.08 0 CA-C-N 118.315 0.507 . . . . 0.0 111.572 178.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 124.82 -25.5 5.84 Favored Glycine 0 C--N 1.35 1.312 0 CA-C-O 119.323 -0.71 . . . . 0.0 113.17 -177.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.409 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 10.0 m170 -56.15 140.01 45.59 Favored 'General case' 0 N--CA 1.49 1.574 0 CA-C-N 117.25 0.525 . . . . 0.0 110.498 173.87 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.47 ' HB3' HG22 ' A' ' 19' ' ' ILE . 61.2 mttp -133.99 151.42 51.45 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.905 0.882 . . . . 0.0 110.634 -173.429 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.437 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 89.1 p -164.51 -173.86 3.22 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.82 1.248 . . . . 0.0 107.842 173.606 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 20.0 p -79.12 149.99 31.89 Favored 'General case' 0 C--O 1.244 0.766 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 173.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 63.2 pttt -65.6 -18.1 65.07 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.161 0.584 . . . . 0.0 112.169 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -62.13 -40.75 96.98 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 123.318 0.647 . . . . 0.0 111.332 172.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.8 m -59.52 -52.8 64.01 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.618 0.767 . . . . 0.0 111.174 179.273 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.517 HG21 HG11 ' A' ' 55' ' ' VAL . 9.3 tp -73.18 -32.89 40.15 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.708 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.99 -174.41 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -61.47 -44.95 96.19 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-O 121.014 0.435 . . . . 0.0 109.986 177.567 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -60.15 -40.29 89.36 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 114.784 -1.098 . . . . 0.0 110.974 173.693 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 73.0 t60 -73.85 -33.15 63.99 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 114.759 -1.109 . . . . 0.0 111.698 -174.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 78.8 mt -71.79 -9.13 57.86 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 123.521 0.729 . . . . 0.0 112.102 -176.522 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 17.5 mmt -74.72 -24.6 58.76 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 123.18 0.592 . . . . 0.0 109.747 172.274 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 39.2 t30 -111.34 -73.13 0.69 Allowed 'General case' 0 CA--C 1.555 1.141 0 C-N-CA 124.532 1.133 . . . . 0.0 110.344 -178.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -120.71 -175.17 2.97 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 123.976 0.91 . . . . 0.0 111.15 -175.434 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt -136.63 20.25 3.1 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 123.831 0.852 . . . . 0.0 109.6 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -85.85 164.13 17.7 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 121.291 0.567 . . . . 0.0 110.868 -177.789 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.409 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 53.5 t -91.39 38.65 0.98 Allowed 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.067 0.947 . . . . 0.0 111.97 -173.165 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 57.43 -84.66 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 125.756 1.622 . . . . 0.0 112.627 171.416 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 -67.64 -50.43 58.02 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.593 1.157 . . . . 0.0 110.644 -169.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 14.7 p -97.63 -7.85 30.17 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.387 -177.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt 59.94 13.19 3.51 Favored 'General case' 0 CA--C 1.57 1.744 0 C-N-CA 125.506 1.522 . . . . 0.0 114.299 177.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 55.7 m -64.32 134.17 54.13 Favored 'General case' 0 N--CA 1.479 0.979 0 O-C-N 121.249 -0.907 . . . . 0.0 110.44 176.703 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 25.6 m -63.11 112.54 2.68 Favored 'General case' 0 C--O 1.245 0.868 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 177.75 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.486 HG21 HG22 ' A' ' 55' ' ' VAL . 30.5 mt -69.49 124.02 24.44 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 O-C-N 123.728 0.642 . . . . 0.0 109.825 -174.737 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 89.7 t -71.01 -51.31 36.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 O-C-N 123.705 0.628 . . . . 0.0 109.799 177.15 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 36.2 p -143.34 133.18 23.98 Favored 'General case' 0 C--O 1.249 1.026 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.703 178.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.517 HG11 HG21 ' A' ' 35' ' ' ILE . 23.3 t -102.04 106.97 20.69 Favored 'Isoleucine or valine' 0 C--N 1.348 0.528 0 N-CA-C 107.933 -1.136 . . . . 0.0 107.933 174.355 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -115.7 157.4 24.32 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.63 0.772 . . . . 0.0 110.215 -174.059 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -77.96 128.1 33.39 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . 0.46 ' CZ3' ' HA ' ' A' ' 60' ' ' LYS . 74.7 t90 -114.19 105.04 12.71 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 175.526 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -61.23 124.98 22.11 Favored 'General case' 0 C--O 1.242 0.686 0 C-N-CA 123.311 0.644 . . . . 0.0 109.373 173.687 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.518 ' HG3' ' HB2' ' A' ' 18' ' ' PRO . 11.9 tmtt? -66.47 -59.17 3.91 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.851 0.86 . . . . 0.0 110.895 -169.374 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.986 0 CA-C-O 118.771 -1.016 . . . . 0.0 112.839 -179.48 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 54.5 p . . . . . 0 N--CA 1.481 1.095 0 CA-C-O 120.62 0.248 . . . . 0.0 110.773 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 4.7 p80 -80.65 158.35 25.67 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.348 0.659 . . . . 0.0 110.264 176.327 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 15.7 ptm -149.66 74.82 9.45 Favored Pre-proline 0 CA--C 1.554 1.134 0 C-N-CA 123.682 0.793 . . . . 0.0 109.614 -175.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_exo -65.17 -49.08 2.91 Favored 'Trans proline' 0 C--N 1.381 2.253 0 C-N-CA 122.92 2.413 . . . . 0.0 112.174 -177.442 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 18.1 p -118.46 98.52 6.3 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.737 1.215 . . . . 0.0 109.426 -177.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 64.8 m -133.38 104.42 6.42 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.788 0.835 . . . . 0.0 109.023 179.14 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -116.26 -77.63 0.57 Allowed 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 -178.03 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -170.55 172.92 5.71 Favored 'General case' 0 C--O 1.247 0.937 0 C-N-CA 125.111 1.365 . . . . 0.0 108.733 175.285 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 58.17 36.24 25.67 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 124.164 0.986 . . . . 0.0 109.76 -172.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.598 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 90.2 mt -74.95 139.9 43.33 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.404 0.682 . . . . 0.0 110.097 -176.92 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 50.5 t -57.95 115.05 9.85 Favored Pre-proline 0 CA--C 1.548 0.901 0 O-C-N 123.874 0.734 . . . . 0.0 109.794 178.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_endo -57.45 -18.11 30.22 Favored 'Trans proline' 0 N--CA 1.508 2.335 0 C-N-CA 123.505 2.803 . . . . 0.0 114.034 -172.704 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 56.7 mt -90.29 -42.62 14.22 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.068 0 C-N-CA 123.954 0.902 . . . . 0.0 111.629 178.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 77.7 m -95.24 -53.37 3.81 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 123.114 0.566 . . . . 0.0 110.852 -171.645 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 20.4 t80 80.02 -41.57 0.22 Allowed 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 126.458 1.903 . . . . 0.0 112.617 175.192 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -70.03 -15.1 62.96 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.674 0.79 . . . . 0.0 112.128 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 33.7 m170 -132.1 153.38 81.32 Favored Pre-proline 0 CA--C 1.551 1.017 0 C-N-CA 124.402 1.081 . . . . 0.0 108.588 178.177 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.598 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 60.9 Cg_endo -78.82 -166.23 0.39 Allowed 'Trans proline' 0 C--N 1.379 2.141 0 C-N-CA 123.124 2.549 . . . . 0.0 113.67 -175.238 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.409 HD11 ' HB2' ' A' ' 29' ' ' LYS . 91.3 mt -96.9 146.07 7.99 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.696 0 C-N-CA 124.733 1.213 . . . . 0.0 109.313 174.185 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 28.1 t -141.96 -14.7 0.81 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 123.132 0.573 . . . . 0.0 111.805 176.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -130.95 134.21 46.52 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.135 0.574 . . . . 0.0 110.836 -174.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.488 ' HB ' ' HB2' ' A' ' 58' ' ' TRP . 7.3 p -115.85 140.34 38.14 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 124.041 0.937 . . . . 0.0 110.288 176.227 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -84.71 89.6 7.54 Favored 'General case' 0 C--O 1.242 0.66 0 C-N-CA 124.454 1.101 . . . . 0.0 108.471 175.217 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.406 ' HB3' ' HB3' ' A' ' 54' ' ' SER . 35.7 tt0 -82.18 140.77 45.95 Favored Pre-proline 0 CA--C 1.552 1.034 0 C-N-CA 124.325 1.05 . . . . 0.0 109.988 -177.058 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 14.9 Cg_endo -97.95 31.15 12.26 Favored 'Cis proline' 0 C--N 1.384 2.4 0 CA-C-N 120.226 1.116 . . . . 0.0 114.195 1.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 43.5 t -75.02 -40.91 60.26 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -177.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 85.52 23.64 46.31 Favored Glycine 0 C--N 1.345 1.045 0 C-N-CA 121.619 -0.324 . . . . 0.0 113.655 -176.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.497 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 24.8 m170 -104.59 147.84 27.18 Favored 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 166.812 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.409 ' HB2' HD11 ' A' ' 19' ' ' ILE . 6.3 mptt -132.41 169.47 16.48 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-O 121.602 0.715 . . . . 0.0 112.126 -171.039 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 84.3 p -169.19 -166.43 0.62 Allowed 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.664 1.586 . . . . 0.0 107.594 170.225 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 19.0 p -89.37 154.42 20.08 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 168.248 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.9 -33.99 72.6 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.415 0.686 . . . . 0.0 110.859 -176.551 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -54.88 -40.54 69.85 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.9 0.88 . . . . 0.0 112.52 177.519 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 9.0 m -62.01 -54.56 39.91 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.553 0.741 . . . . 0.0 111.21 178.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 9.5 tp -69.53 -32.55 53.28 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 O-C-N 123.055 0.222 . . . . 0.0 110.739 -175.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 4.6 t30 -58.77 -48.03 82.66 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.643 0.777 . . . . 0.0 110.626 176.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -62.46 -42.18 99.3 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 114.866 -1.061 . . . . 0.0 111.014 176.117 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 52.2 t60 -63.49 -38.52 91.45 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.695 0.798 . . . . 0.0 111.049 -178.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 96.1 mt -69.81 -11.29 60.74 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.809 0.844 . . . . 0.0 112.051 -177.116 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 45.6 mtm -76.48 -15.22 59.95 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 122.821 0.448 . . . . 0.0 111.059 172.545 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 19.3 m-80 -121.09 -64.91 1.19 Allowed 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 124.463 1.105 . . . . 0.0 110.376 -173.726 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 31.1 m-80 -126.81 -174.42 3.13 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 124.842 1.257 . . . . 0.0 109.468 -177.376 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp -137.18 68.89 1.41 Allowed 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 178.063 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.1 m-20 -139.21 165.79 26.24 Favored 'General case' 0 N--CA 1.494 1.726 0 CA-C-O 121.908 0.861 . . . . 0.0 112.076 -168.616 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.497 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 43.7 t -89.67 24.32 2.37 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 125.154 1.382 . . . . 0.0 112.239 -172.03 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 58.93 -86.0 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 125.158 1.383 . . . . 0.0 112.495 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -67.64 -40.39 84.59 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 125.407 1.483 . . . . 0.0 111.382 -162.239 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 7.5 p -108.74 -2.48 18.56 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.181 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 64.5 tttp 66.97 -2.27 1.19 Allowed 'General case' 0 CA--C 1.565 1.526 0 N-CA-C 114.657 1.355 . . . . 0.0 114.657 174.054 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 24.2 m -55.77 124.29 17.02 Favored 'General case' 0 N--CA 1.489 1.523 0 CA-C-N 119.16 0.891 . . . . 0.0 111.112 178.671 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 89.2 m -57.28 134.54 56.05 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.289 0.635 . . . . 0.0 111.674 -178.549 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 48.8 mm -62.38 118.67 4.95 Favored 'Isoleucine or valine' 0 C--N 1.354 0.768 0 C-N-CA 123.511 0.724 . . . . 0.0 110.732 -176.241 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 59.9 t -90.92 -40.33 12.54 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 172.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.406 ' HB3' ' HB3' ' A' ' 24' ' ' GLN . 24.9 t -154.35 146.79 23.98 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.49 0.716 . . . . 0.0 110.148 179.061 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 66.0 t -112.66 103.19 15.05 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 168.59 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -97.25 156.36 16.46 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.528 0.731 . . . . 0.0 109.114 178.046 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -75.65 107.7 7.98 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 170.007 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . 0.488 ' HB2' ' HB ' ' A' ' 22' ' ' VAL . 39.3 t90 -75.73 103.66 5.93 Favored 'General case' 0 C--O 1.241 0.651 0 O-C-N 123.237 0.336 . . . . 0.0 110.21 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -76.71 133.6 39.46 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 170.292 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -70.5 -22.9 62.59 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.816 0.846 . . . . 0.0 111.884 -176.042 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.969 0 N-CA-C 110.4 -1.08 . . . . 0.0 110.4 -175.411 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 35.4 p . . . . . 0 N--CA 1.478 0.95 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 44.9 t-80 66.67 117.45 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 125.715 1.606 . . . . 0.0 110.673 -179.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 11.8 tpt 58.25 64.92 3.42 Favored Pre-proline 0 CA--C 1.561 1.394 0 C-N-CA 124.595 1.158 . . . . 0.0 109.463 -170.544 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_exo -75.34 82.81 1.98 Allowed 'Trans proline' 0 C--N 1.385 2.497 0 C-N-CA 123.079 2.52 . . . . 0.0 111.509 -178.178 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 35.0 p -86.65 61.86 7.07 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 124.395 1.078 . . . . 0.0 110.574 179.496 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 46.1 m -126.49 118.83 25.73 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.279 1.031 . . . . 0.0 108.876 -178.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -100.59 109.37 21.45 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.283 0.633 . . . . 0.0 110.335 178.604 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.534 ' HG2' ' H ' ' A' ' 9' ' ' ASP . 32.8 tt0 -160.02 -179.8 8.09 Favored 'General case' 0 CA--C 1.56 1.333 0 C-N-CA 124.825 1.25 . . . . 0.0 107.938 179.053 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.534 ' H ' ' HG2' ' A' ' 8' ' ' GLU . 12.6 t70 -79.29 68.19 5.22 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-O 122.595 1.188 . . . . 0.0 108.524 170.959 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.586 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 92.8 mt -83.43 160.6 21.54 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 114.119 -1.4 . . . . 0.0 111.256 -176.721 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 42.5 t -61.61 119.26 45.66 Favored Pre-proline 0 N--CA 1.475 0.794 0 CA-C-O 118.744 -0.646 . . . . 0.0 110.37 178.223 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -67.0 -11.49 32.46 Favored 'Trans proline' 0 C--N 1.376 2.023 0 C-N-CA 122.746 2.297 . . . . 0.0 113.208 -177.748 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 68.4 mt -97.73 -28.41 3.69 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.153 0 C-N-CA 124.52 1.128 . . . . 0.0 111.886 -176.127 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 71.1 m -115.81 -38.87 3.59 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 122.841 0.456 . . . . 0.0 110.807 -173.188 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 11.0 t80 79.98 -54.77 0.38 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 126.703 2.001 . . . . 0.0 111.802 175.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.5 -38.95 85.99 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 124.084 0.953 . . . . 0.0 112.797 -175.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 65.2 m170 -103.88 153.93 38.42 Favored Pre-proline 0 N--CA 1.486 1.371 0 C-N-CA 123.712 0.805 . . . . 0.0 110.445 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.586 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 97.9 Cg_endo -75.27 -167.83 0.47 Allowed 'Trans proline' 0 C--N 1.38 2.221 0 C-N-CA 123.077 2.518 . . . . 0.0 113.597 -177.361 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.493 HG23 ' HB3' ' A' ' 29' ' ' LYS . 38.8 mt -96.94 147.29 6.41 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 C-N-CA 124.005 0.922 . . . . 0.0 109.938 174.676 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 34.3 p -154.87 25.12 0.44 Allowed 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.995 0.918 . . . . 0.0 110.542 179.141 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -152.56 141.81 21.47 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 124.167 0.987 . . . . 0.0 110.031 178.051 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 6.4 p -137.18 118.99 18.78 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 C-N-CA 124.236 1.014 . . . . 0.0 108.442 176.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -85.02 92.95 8.47 Favored 'General case' 0 C--O 1.244 0.812 0 N-CA-C 108.423 -0.955 . . . . 0.0 108.423 -174.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -83.42 152.62 64.49 Favored Pre-proline 0 CA--C 1.545 0.753 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.498 -178.167 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -89.78 18.12 39.52 Favored 'Cis proline' 0 C--N 1.38 2.223 0 N-CA-C 114.297 0.845 . . . . 0.0 114.297 0.413 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 36.6 t -65.4 -64.59 0.83 Allowed 'General case' 0 C--N 1.356 0.871 0 C-N-CA 123.064 0.545 . . . . 0.0 111.84 -176.549 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 125.67 -19.73 6.58 Favored Glycine 0 C--N 1.345 1.062 0 CA-C-O 118.951 -0.916 . . . . 0.0 113.465 -176.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.448 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 9.4 m170 -61.01 144.41 53.45 Favored 'General case' 0 N--CA 1.487 1.409 0 CA-C-N 117.733 0.766 . . . . 0.0 110.494 176.728 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.493 ' HB3' HG23 ' A' ' 19' ' ' ILE . 58.3 mttp -136.48 157.45 46.75 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 123.876 0.87 . . . . 0.0 110.798 -170.534 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 94.6 p -169.04 179.55 4.0 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.86 1.264 . . . . 0.0 108.556 171.739 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 14.4 p -68.12 142.17 55.86 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 171.343 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.99 -21.65 66.29 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -175.104 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -58.63 -38.47 78.14 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.881 0.873 . . . . 0.0 111.329 173.247 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.8 m -58.59 -55.63 32.53 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 124.07 0.948 . . . . 0.0 111.592 177.359 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.497 HG12 HG21 ' A' ' 55' ' ' VAL . 9.2 tp -73.6 -33.86 40.19 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 O-C-N 123.422 0.451 . . . . 0.0 111.19 -173.269 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -62.96 -41.03 99.41 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-O 120.944 0.402 . . . . 0.0 110.429 175.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -74.88 -28.67 60.74 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 123.685 0.794 . . . . 0.0 110.915 176.707 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 83.2 t60 -69.79 -45.81 67.15 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.841 0.856 . . . . 0.0 110.417 -178.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.453 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 97.4 mt -60.82 -19.08 59.06 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 124.083 0.953 . . . . 0.0 112.656 -176.356 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 84.4 mmm -61.56 -32.59 72.67 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.37 1.068 . . . . 0.0 112.002 173.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 77.3 m-20 -116.4 -58.24 2.11 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.34 0.656 . . . . 0.0 111.134 -176.787 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -122.71 160.66 25.41 Favored 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 124.144 0.977 . . . . 0.0 110.947 -176.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 47.6 mtpt -126.46 63.66 1.27 Allowed 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 174.844 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -128.59 158.12 39.37 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 115.136 -0.938 . . . . 0.0 109.944 -174.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.448 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 42.3 t -87.7 37.37 0.79 Allowed 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 123.675 0.79 . . . . 0.0 111.875 -176.396 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 57.6 -85.3 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 125.697 1.599 . . . . 0.0 112.775 173.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 -74.82 -39.07 61.86 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.639 1.176 . . . . 0.0 111.758 -165.217 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 14.2 p -107.05 -2.53 20.97 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 122.952 0.501 . . . . 0.0 110.994 -179.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 83.8 tttt 66.39 -4.18 0.74 Allowed 'General case' 0 CA--C 1.566 1.582 0 C-N-CA 125.492 1.517 . . . . 0.0 114.917 176.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 22.9 m -51.11 121.16 5.7 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 119.27 0.941 . . . . 0.0 111.128 -177.299 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 20.6 m -51.6 127.84 21.49 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.393 0.677 . . . . 0.0 110.772 -177.077 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.453 HG13 HD11 ' A' ' 35' ' ' ILE . 42.4 mm -60.71 103.28 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.353 0.724 0 O-C-N 123.756 0.66 . . . . 0.0 110.64 -175.542 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 47.4 t -75.76 -55.4 11.5 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 CA-C-N 115.047 -0.979 . . . . 0.0 108.44 174.207 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.8 t -153.57 153.06 31.66 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 123.128 0.571 . . . . 0.0 110.582 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.497 HG21 HG12 ' A' ' 35' ' ' ILE . 58.1 t -127.53 127.13 68.43 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 124.532 1.133 . . . . 0.0 108.462 175.428 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -108.64 143.72 37.34 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.599 0.76 . . . . 0.0 109.055 173.128 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -66.13 106.21 1.58 Allowed 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 108.428 -0.952 . . . . 0.0 108.428 174.313 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 72.1 t90 -69.46 95.55 0.83 Allowed 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 177.209 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -91.46 115.74 28.28 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 114.803 -1.089 . . . . 0.0 109.434 -178.799 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -71.27 146.29 49.04 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 122.754 0.421 . . . . 0.0 110.815 -179.753 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 1.426 0 CA-C-O 118.867 -0.963 . . . . 0.0 113.027 -177.155 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 23.2 t . . . . . 0 N--CA 1.475 0.796 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 49.2 m80 -58.91 117.9 5.16 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.292 0.637 . . . . 0.0 110.83 178.17 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 54.1 ttm -164.43 81.94 1.3 Allowed Pre-proline 0 CA--C 1.551 0.989 0 C-N-CA 124.355 1.062 . . . . 0.0 108.566 177.099 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -86.91 -166.96 0.33 Allowed 'Trans proline' 0 C--N 1.375 1.926 0 C-N-CA 123.037 2.491 . . . . 0.0 111.729 178.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 7.0 m 70.99 -5.88 1.41 Allowed 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 124.41 1.084 . . . . 0.0 112.748 173.21 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 21.1 m -80.85 83.78 6.51 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.961 0.904 . . . . 0.0 110.283 -172.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -126.76 100.34 6.15 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.58 0.752 . . . . 0.0 110.069 -178.454 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -163.31 -169.03 1.86 Allowed 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.773 1.229 . . . . 0.0 109.489 179.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -79.43 62.48 3.77 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 168.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.702 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 94.6 mt -83.76 153.81 23.92 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-N 114.828 -1.078 . . . . 0.0 111.777 -173.394 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.404 ' SG ' ' HB ' ' A' ' 13' ' ' ILE . 51.0 t -67.15 114.34 17.97 Favored Pre-proline 0 CA--C 1.545 0.759 0 CA-C-N 114.413 -1.267 . . . . 0.0 109.223 171.583 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -64.0 -8.28 15.66 Favored 'Trans proline' 0 C--N 1.374 1.897 0 C-N-CA 122.814 2.343 . . . . 0.0 113.353 -179.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.404 ' HB ' ' SG ' ' A' ' 11' ' ' CYS . 3.6 mp -84.52 -44.98 17.9 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.989 0 C-N-CA 124.186 0.994 . . . . 0.0 110.172 175.258 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 78.8 m -107.39 -46.87 3.76 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.348 0.659 . . . . 0.0 112.688 -165.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 97.6 m-85 76.81 -39.17 0.33 Allowed 'General case' 0 N--CA 1.499 2.012 0 C-N-CA 126.196 1.798 . . . . 0.0 113.419 178.337 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.75 -20.58 65.25 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.371 0.668 . . . . 0.0 112.797 -177.293 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 80.3 m-70 -134.72 152.74 78.14 Favored Pre-proline 0 C--O 1.248 0.977 0 C-N-CA 123.728 0.811 . . . . 0.0 109.371 -179.14 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.702 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 83.0 Cg_endo -72.66 -166.07 0.26 Allowed 'Trans proline' 0 C--N 1.38 2.224 0 C-N-CA 122.925 2.417 . . . . 0.0 113.822 -178.291 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.555 HG22 ' HB3' ' A' ' 29' ' ' LYS . 92.4 mt -94.64 146.0 7.33 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 C-N-CA 124.469 1.108 . . . . 0.0 108.63 172.922 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 18.9 t -147.33 9.36 0.95 Allowed 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.172 0.589 . . . . 0.0 110.922 178.26 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.417 ' HA ' ' HA ' ' A' ' 57' ' ' ASP . . . -142.29 141.96 32.48 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.173 0.589 . . . . 0.0 110.677 -179.014 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.1 p -119.35 136.99 54.73 Favored 'Isoleucine or valine' 0 C--O 1.245 0.83 0 C-N-CA 124.08 0.952 . . . . 0.0 109.491 177.763 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.416 ' HB3' HG12 ' A' ' 52' ' ' ILE . 10.3 m-30 -98.63 87.44 3.8 Favored 'General case' 0 C--O 1.241 0.644 0 C-N-CA 123.877 0.871 . . . . 0.0 109.057 -177.134 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 17.0 mt-30 -81.9 147.6 58.73 Favored Pre-proline 0 CA--C 1.546 0.803 0 CA-C-N 115.217 -0.901 . . . . 0.0 111.383 -176.403 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.503 ' HD3' ' HB ' ' A' ' 53' ' ' VAL . 43.6 Cg_endo -97.44 24.36 22.42 Favored 'Cis proline' 0 C--N 1.374 1.871 0 C-N-CA 125.322 -0.699 . . . . 0.0 113.384 -0.267 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 37.5 t -71.53 -49.37 41.49 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 122.696 0.398 . . . . 0.0 110.759 -179.102 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 108.79 -12.66 35.12 Favored Glycine 0 C--N 1.348 1.229 0 CA-C-O 119.429 -0.651 . . . . 0.0 114.032 179.119 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.411 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 11.1 m80 -64.53 143.51 57.86 Favored 'General case' 0 N--CA 1.484 1.269 0 CA-C-N 117.391 0.596 . . . . 0.0 110.351 173.487 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.555 ' HB3' HG22 ' A' ' 19' ' ' ILE . 96.2 mttt -135.54 149.6 49.51 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.632 0.773 . . . . 0.0 110.844 -168.831 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 47.2 t -157.64 173.75 16.38 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.253 1.021 . . . . 0.0 109.069 178.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 12.3 p -68.0 146.87 53.13 Favored 'General case' 0 C--O 1.243 0.757 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 176.161 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt -61.78 -28.25 69.32 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.456 0.702 . . . . 0.0 111.777 -174.479 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -62.68 -42.18 99.49 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.765 0.826 . . . . 0.0 111.933 178.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.1 m -56.09 -56.21 23.65 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.315 0.646 . . . . 0.0 111.271 178.408 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.432 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 7.7 tp -73.67 -34.37 41.08 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.75 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.285 -173.767 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -56.85 -46.76 81.56 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 123.294 0.637 . . . . 0.0 110.429 177.054 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -66.41 -40.64 89.71 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.68 176.271 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 82.5 t60 -74.16 -24.28 59.37 Favored 'General case' 0 C--O 1.215 -0.754 0 CA-C-N 115.272 -0.877 . . . . 0.0 112.722 -172.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.432 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 73.2 mt -61.95 -22.41 65.6 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 122.985 0.514 . . . . 0.0 111.976 -179.143 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 24.6 mmt -75.34 -31.14 60.47 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 123.697 0.799 . . . . 0.0 110.643 174.241 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 23.6 m-20 -84.18 -76.33 0.3 Allowed 'General case' 0 CA--C 1.553 1.058 0 C-N-CA 123.937 0.895 . . . . 0.0 109.251 177.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -141.45 -167.23 2.37 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 125.198 1.399 . . . . 0.0 109.641 -176.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -141.98 87.72 2.06 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 173.516 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -152.17 162.42 41.15 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.062 179.564 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.411 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 79.3 m -62.18 142.33 57.7 Favored 'General case' 0 C--N 1.347 0.465 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.206 173.605 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 71.1 m-85 -82.86 26.34 0.6 Allowed 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.379 0.672 . . . . 0.0 110.271 172.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 48.4 m-85 -139.38 -77.2 0.34 Allowed 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 124.21 1.004 . . . . 0.0 108.93 -169.11 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.421 ' SG ' ' OG1' ' A' ' 50' ' ' THR . 1.8 p -95.07 -1.86 51.28 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.178 0.591 . . . . 0.0 111.394 -177.388 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.61 ' HZ2' ' HB2' ' A' ' 49' ' ' LYS . 8.6 mtmp? 63.78 9.54 4.5 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 125.04 1.336 . . . . 0.0 113.928 176.598 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.421 ' OG1' ' SG ' ' A' ' 48' ' ' CYS . 87.4 m -65.6 128.84 37.57 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.236 0.614 . . . . 0.0 111.116 177.351 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 56.9 m -58.16 133.64 55.79 Favored 'General case' 0 C--N 1.352 0.695 0 O-C-N 124.456 1.098 . . . . 0.0 111.512 178.306 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.421 HG21 HG23 ' A' ' 55' ' ' VAL . 30.8 mt -86.6 119.9 35.33 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 C-N-CA 123.907 0.883 . . . . 0.0 109.716 -177.621 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.503 ' HB ' ' HD3' ' A' ' 25' ' ' PRO . 61.1 t -78.91 -35.46 17.86 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.922 0 C-N-CA 123.096 0.558 . . . . 0.0 109.96 178.85 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.7 t -145.91 131.7 19.03 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 122.941 0.496 . . . . 0.0 110.331 175.46 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.421 HG23 HG21 ' A' ' 52' ' ' ILE . 56.6 t -100.48 111.89 31.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 175.771 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -117.71 -178.52 3.5 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 123.095 0.558 . . . . 0.0 110.179 174.544 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.417 ' HA ' ' HA ' ' A' ' 21' ' ' ALA . 35.9 m-20 -100.05 164.37 12.02 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.589 0.756 . . . . 0.0 109.947 178.446 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 54.7 t90 -139.83 111.75 7.45 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 179.594 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -80.41 151.15 29.5 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.163 0.585 . . . . 0.0 110.26 177.592 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -155.66 129.74 8.74 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 177.812 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.095 0 N-CA-C 111.053 -0.819 . . . . 0.0 111.053 178.891 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 25.9 p . . . . . 0 N--CA 1.469 0.507 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 79.0 m80 -135.05 179.97 5.99 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.234 1.013 . . . . 0.0 110.13 -178.329 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.409 ' SD ' ' N ' ' A' ' 3' ' ' MET . 1.0 OUTLIER -96.94 93.71 1.52 Allowed Pre-proline 0 CA--C 1.548 0.879 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 168.594 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -86.99 11.4 3.27 Favored 'Trans proline' 0 C--N 1.375 1.957 0 C-N-CA 122.848 2.365 . . . . 0.0 113.615 -170.508 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 87.6 m -145.67 -82.53 0.14 Allowed 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 123.631 0.772 . . . . 0.0 109.604 178.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 74.3 m -164.4 171.58 14.54 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 124.468 1.107 . . . . 0.0 109.715 -176.533 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 64.45 -178.08 0.17 Allowed 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 124.823 1.249 . . . . 0.0 113.868 168.014 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -116.59 -163.31 0.9 Allowed 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 114.268 -1.333 . . . . 0.0 109.059 175.521 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 57.85 26.8 13.69 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 123.934 0.894 . . . . 0.0 111.123 -177.246 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.597 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 59.6 mt -65.34 129.1 38.53 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 123.514 0.725 . . . . 0.0 110.577 -174.78 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 46.1 t -50.19 114.78 4.69 Favored Pre-proline 0 CA--C 1.546 0.825 0 O-C-N 124.387 1.054 . . . . 0.0 109.869 179.445 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_exo -57.55 -14.33 16.45 Favored 'Trans proline' 0 C--N 1.38 2.236 0 C-N-CA 123.352 2.701 . . . . 0.0 114.358 -172.778 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.6 mp -89.51 -42.47 14.4 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.253 0 C-N-CA 124.272 1.029 . . . . 0.0 110.047 177.507 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 79.8 m -102.12 -55.03 2.57 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.599 0.76 . . . . 0.0 112.688 -169.04 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.506 ' HA ' ' HB3' ' A' ' 10' ' ' LEU . 96.0 m-85 77.09 -32.29 0.18 Allowed 'General case' 0 N--CA 1.495 1.804 0 C-N-CA 126.318 1.847 . . . . 0.0 113.345 -178.528 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.5 -36.91 79.48 Favored 'General case' 0 N--CA 1.484 1.25 0 CA-C-N 118.564 0.62 . . . . 0.0 111.917 -179.152 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 10.9 m170 -127.07 155.14 76.42 Favored Pre-proline 0 N--CA 1.482 1.145 0 C-N-CA 124.441 1.097 . . . . 0.0 109.139 178.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.597 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 92.6 Cg_endo -76.91 -159.6 0.1 Allowed 'Trans proline' 0 C--N 1.376 2.023 0 C-N-CA 122.707 2.272 . . . . 0.0 113.936 179.379 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.417 HG21 ' HB3' ' A' ' 29' ' ' LYS . 83.0 mt -78.58 138.0 20.95 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.799 0 C-N-CA 124.285 1.034 . . . . 0.0 110.906 177.504 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.2 m -110.8 -27.77 8.71 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.568 0.747 . . . . 0.0 110.731 176.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.436 ' HB1' HG13 ' A' ' 55' ' ' VAL . . . -147.58 154.16 40.34 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.096 0.558 . . . . 0.0 111.778 -166.097 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 5.7 p -123.46 124.81 70.51 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.95 0 C-N-CA 124.552 1.141 . . . . 0.0 109.851 179.311 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -77.41 94.7 4.28 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.12 0.968 . . . . 0.0 108.97 178.55 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 -98.09 155.46 36.98 Favored Pre-proline 0 CA--C 1.546 0.823 0 C-N-CA 123.054 0.542 . . . . 0.0 111.14 -174.603 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -85.72 18.89 27.95 Favored 'Cis proline' 0 C--N 1.383 2.378 0 N-CA-C 115.049 1.134 . . . . 0.0 115.049 3.342 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 53.4 t -67.8 -65.07 0.74 Allowed 'General case' 0 C--N 1.354 0.765 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -177.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 124.93 -16.87 7.25 Favored Glycine 0 C--N 1.35 1.313 0 CA-C-O 119.13 -0.817 . . . . 0.0 114.211 179.5 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.562 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 21.5 m80 -63.94 149.14 47.89 Favored 'General case' 0 N--CA 1.482 1.146 0 CA-C-N 117.644 0.722 . . . . 0.0 110.206 171.987 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.417 ' HB3' HG21 ' A' ' 19' ' ' ILE . 83.1 mttt -137.22 161.58 35.82 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 123.703 0.801 . . . . 0.0 110.77 -168.324 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 38.3 t -172.98 178.65 2.48 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.847 1.259 . . . . 0.0 108.714 178.344 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 13.6 p -79.36 153.11 30.01 Favored 'General case' 0 C--O 1.246 0.9 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 173.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt -67.19 -23.6 65.77 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.289 0.636 . . . . 0.0 111.767 -173.353 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.51 -42.29 92.22 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.744 0.818 . . . . 0.0 111.553 177.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 8.7 m -56.78 -54.5 45.63 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.447 0.699 . . . . 0.0 110.851 176.429 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.501 HG12 HG21 ' A' ' 55' ' ' VAL . 9.8 tp -74.97 -23.36 17.39 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.982 0 O-C-N 123.688 0.617 . . . . 0.0 111.11 -174.67 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -62.56 -55.41 27.49 Favored 'General case' 0 N--CA 1.487 1.414 0 CA-C-O 121.505 0.669 . . . . 0.0 109.868 173.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 61.0 tt0 -70.44 -19.55 62.96 Favored 'General case' 0 CA--C 1.553 1.06 0 CA-C-N 114.519 -1.219 . . . . 0.0 111.063 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 62.7 t60 -81.51 -41.74 21.25 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.347 0.659 . . . . 0.0 111.367 178.685 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 48.9 mt -66.85 -24.49 66.15 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.122 0.569 . . . . 0.0 112.527 -173.445 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 27.3 ptm -69.99 -21.21 63.25 Favored 'General case' 0 N--CA 1.482 1.174 0 CA-C-O 120.576 0.226 . . . . 0.0 110.957 175.315 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 66.0 m-20 -106.02 -73.86 0.67 Allowed 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.882 0.873 . . . . 0.0 109.749 -179.041 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -111.68 -174.57 2.49 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 124.545 1.138 . . . . 0.0 110.491 -176.736 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 22.1 ttmm -139.82 15.64 2.49 Favored 'General case' 0 N--CA 1.486 1.33 0 CA-C-O 121.484 0.659 . . . . 0.0 110.665 179.63 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -88.86 164.17 15.31 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-O 121.326 0.584 . . . . 0.0 111.408 -174.469 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.562 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 43.5 t -91.66 32.87 1.05 Allowed 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 124.526 1.13 . . . . 0.0 112.664 -172.427 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 57.7 -83.46 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 125.231 1.413 . . . . 0.0 112.646 174.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -67.55 -24.96 65.59 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 125.505 1.522 . . . . 0.0 112.735 -167.022 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.429 ' SG ' ' OG1' ' A' ' 50' ' ' THR . 15.2 p -131.03 -7.48 3.9 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 122.93 0.492 . . . . 0.0 111.195 -176.784 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 55.2 tttm 64.48 11.91 6.96 Favored 'General case' 0 CA--C 1.569 1.691 0 C-N-CA 124.784 1.234 . . . . 0.0 113.548 177.002 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.429 ' OG1' ' SG ' ' A' ' 48' ' ' CYS . 26.7 m -62.86 133.7 55.1 Favored 'General case' 0 N--CA 1.481 1.088 0 O-C-N 121.407 -0.808 . . . . 0.0 110.451 176.412 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 23.8 m -60.79 119.84 8.96 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.112 0.565 . . . . 0.0 110.323 179.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.448 HG23 HG23 ' A' ' 55' ' ' VAL . 46.6 mt -79.54 122.2 34.29 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 O-C-N 123.454 0.471 . . . . 0.0 109.754 -179.68 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 46.2 t -81.53 -38.53 16.3 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 C-N-CA 123.208 0.603 . . . . 0.0 109.553 175.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 34.2 p -168.11 136.97 2.41 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.706 0.803 . . . . 0.0 110.713 175.615 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.501 HG21 HG12 ' A' ' 35' ' ' ILE . 21.7 t -96.72 113.56 31.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 123.87 0.868 . . . . 0.0 109.254 178.064 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.1 mm-40 -85.24 172.86 10.82 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 110.073 -0.343 . . . . 0.0 110.073 175.313 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -87.52 135.56 33.3 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 174.212 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 73.4 t90 -117.78 120.84 39.15 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 175.698 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -138.57 141.75 39.24 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.416 1.086 . . . . 0.0 109.431 178.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 59.5 mtmt -80.6 79.37 7.23 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-O 121.501 0.667 . . . . 0.0 109.402 172.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.664 -1.075 . . . . 0.0 110.88 -176.671 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 46.3 t . . . . . 0 N--CA 1.482 1.172 0 CA-C-O 120.961 0.41 . . . . 0.0 110.212 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 50.9 m-70 -103.8 -10.54 18.18 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.283 1.033 . . . . 0.0 110.265 178.713 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 22.2 ttt -104.74 104.93 48.54 Favored Pre-proline 0 CA--C 1.556 1.204 0 C-N-CA 124.162 0.985 . . . . 0.0 108.945 -178.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -85.23 59.56 5.3 Favored 'Trans proline' 0 C--N 1.378 2.119 0 C-N-CA 123.317 2.678 . . . . 0.0 112.896 -176.137 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 13.7 m -64.89 114.44 4.52 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.088 0.955 . . . . 0.0 111.645 -174.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.3 t -152.34 92.55 1.7 Allowed 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.303 0.641 . . . . 0.0 109.564 -178.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.405 ' HG3' HD12 ' A' ' 10' ' ' LEU . 3.6 mp0 -75.43 133.95 41.01 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.993 176.334 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -112.97 38.12 2.92 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 108.328 -0.989 . . . . 0.0 108.328 168.497 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.482 ' HB3' HD13 ' A' ' 19' ' ' ILE . 13.9 m-20 75.17 77.37 0.1 Allowed 'General case' 0 C--N 1.359 1.016 0 C-N-CA 126.476 1.911 . . . . 0.0 109.525 -167.697 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.584 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 93.3 mt -93.5 157.89 15.98 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 114.65 -1.159 . . . . 0.0 110.617 178.766 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.461 ' HB3' ' HB2' ' A' ' 14' ' ' CYS . 42.4 t -66.74 116.42 34.77 Favored Pre-proline 0 CA--C 1.552 1.041 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 175.468 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_endo -58.23 -17.28 31.78 Favored 'Trans proline' 0 C--N 1.382 2.321 0 C-N-CA 123.417 2.745 . . . . 0.0 114.119 -174.683 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 73.3 mt -88.17 -45.88 15.81 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.885 0 C-N-CA 123.882 0.873 . . . . 0.0 110.788 176.544 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.461 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . 86.3 m -90.76 -55.58 3.51 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.126 0.57 . . . . 0.0 111.73 -167.861 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 84.3 m-85 74.84 -43.32 0.52 Allowed 'General case' 0 N--CA 1.494 1.743 0 C-N-CA 126.285 1.834 . . . . 0.0 111.872 -174.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.3 -30.6 71.26 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 124.004 0.921 . . . . 0.0 112.372 -178.752 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 21.7 m-70 -124.4 151.23 66.35 Favored Pre-proline 0 N--CA 1.479 1.016 0 C-N-CA 124.047 0.939 . . . . 0.0 109.521 176.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.584 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 13.1 Cg_exo -71.36 -164.55 0.16 Allowed 'Trans proline' 0 C--N 1.381 2.259 0 C-N-CA 123.898 3.066 . . . . 0.0 114.086 -177.075 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.482 HD13 ' HB3' ' A' ' 9' ' ' ASP . 83.2 mt -86.51 129.93 37.52 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.84 0 C-N-CA 123.466 0.706 . . . . 0.0 110.065 175.726 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 25.8 t -132.46 6.44 4.11 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 123.876 0.87 . . . . 0.0 110.875 178.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -154.95 160.93 41.48 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-O 121.343 0.592 . . . . 0.0 111.413 -178.279 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 4.7 p -145.71 139.76 21.52 Favored 'Isoleucine or valine' 0 C--O 1.244 0.781 0 C-N-CA 124.863 1.265 . . . . 0.0 108.752 177.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -96.79 88.11 4.5 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 178.125 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 16.1 mt-30 -84.95 149.41 53.24 Favored Pre-proline 0 C--O 1.242 0.704 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.359 -176.407 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -92.29 22.38 29.34 Favored 'Cis proline' 0 C--N 1.383 2.368 0 N-CA-C 114.776 1.029 . . . . 0.0 114.776 2.209 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 35.3 t -69.13 -50.12 50.85 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 122.767 0.427 . . . . 0.0 111.555 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 105.58 -6.08 41.23 Favored Glycine 0 C--N 1.343 0.96 0 CA-C-O 118.967 -0.907 . . . . 0.0 114.619 177.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.431 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 3.8 m170 -62.99 128.14 34.47 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 117.662 0.731 . . . . 0.0 110.016 173.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -101.21 156.82 17.21 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.219 1.008 . . . . 0.0 110.897 -174.049 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 79.9 p -168.72 -157.34 0.19 Allowed 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.415 1.086 . . . . 0.0 108.257 175.176 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 30.8 p -116.44 161.19 19.46 Favored 'General case' 0 C--O 1.247 0.964 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 170.179 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 57.5 mtpt -57.07 -40.17 76.39 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 123.494 0.718 . . . . 0.0 111.12 -179.295 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -53.83 -42.13 68.12 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 123.918 0.887 . . . . 0.0 113.086 179.197 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 8.7 m -60.32 -56.63 19.1 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.653 0.781 . . . . 0.0 111.274 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.403 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 8.6 tp -72.92 -35.36 48.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.519 -171.901 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -61.29 -47.45 85.91 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.207 0.603 . . . . 0.0 111.279 177.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 37.0 tt0 -62.94 -34.38 77.35 Favored 'General case' 0 CA--C 1.554 1.102 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.657 176.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 84.8 t60 -73.56 -37.51 65.52 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.274 1.03 . . . . 0.0 112.477 -178.334 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 77.8 mt -64.6 -17.56 64.11 Favored 'General case' 0 N--CA 1.492 1.644 0 C-N-CA 123.505 0.722 . . . . 0.0 112.569 -174.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 87.1 mtp -66.86 -29.16 68.99 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.297 0.639 . . . . 0.0 111.021 174.271 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 31.5 t30 -105.15 -72.89 0.69 Allowed 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 123.91 0.884 . . . . 0.0 110.269 177.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 79.3 m-20 -115.98 164.61 14.17 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.45 0.7 . . . . 0.0 110.783 -173.873 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -124.51 45.65 2.47 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.065 0.946 . . . . 0.0 108.93 176.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -109.18 168.65 9.22 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.498 177.547 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.431 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 41.6 t -93.61 32.5 1.39 Allowed 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 124.668 1.187 . . . . 0.0 111.922 -171.414 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 59.4 -84.35 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 125.616 1.566 . . . . 0.0 112.287 175.817 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 16.4 m-85 -70.6 -32.98 70.54 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.879 1.272 . . . . 0.0 112.05 -164.606 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 14.8 p -119.53 -6.2 10.24 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 122.926 0.49 . . . . 0.0 111.161 -178.109 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 55.4 mtpt 60.28 18.69 8.21 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 114.82 1.415 . . . . 0.0 114.82 178.559 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 45.6 m -62.9 137.1 58.18 Favored 'General case' 0 N--CA 1.48 1.053 0 CA-C-N 118.173 0.442 . . . . 0.0 109.936 174.081 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 29.0 m -58.15 129.64 42.93 Favored 'General case' 0 C--O 1.246 0.9 0 C-N-CA 123.24 0.616 . . . . 0.0 110.331 177.69 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 41.9 mm -66.64 102.01 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.814 0 O-C-N 123.724 0.64 . . . . 0.0 109.724 179.046 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 97.7 t -73.16 -37.69 53.17 Favored 'Isoleucine or valine' 0 C--O 1.242 0.687 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 172.071 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.8 p -158.57 133.21 8.17 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.455 174.521 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 48.5 t -90.37 116.99 32.75 Favored 'Isoleucine or valine' 0 C--N 1.353 0.73 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 163.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -122.63 135.55 54.64 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 177.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -60.92 159.16 11.81 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.665 0.786 . . . . 0.0 110.201 173.344 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 37.3 t90 -146.63 140.81 26.3 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 -177.138 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -129.15 146.92 50.98 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.849 0.86 . . . . 0.0 110.494 -172.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.459 ' HE2' ' HB2' ' A' ' 9' ' ' ASP . 35.0 mmtp -72.89 -41.26 64.82 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 123.662 0.785 . . . . 0.0 110.13 172.914 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.326 0 CA-C-O 118.963 -0.909 . . . . 0.0 110.841 -179.939 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 34.9 p . . . . . 0 N--CA 1.471 0.618 0 N-CA-C 110.315 -0.254 . . . . 0.0 110.315 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 9.4 p80 -110.24 166.39 11.0 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 172.197 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.453 ' HE3' HG23 ' A' ' 5' ' ' THR . 26.7 ttt 61.96 90.48 0.09 OUTLIER Pre-proline 0 CA--C 1.556 1.197 0 C-N-CA 124.44 1.096 . . . . 0.0 111.504 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -80.32 93.51 1.04 Allowed 'Trans proline' 0 C--N 1.368 1.556 0 C-N-CA 122.68 2.254 . . . . 0.0 110.012 174.415 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.453 HG23 ' HE3' ' A' ' 3' ' ' MET . 74.8 p -66.28 137.08 56.69 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.388 0.675 . . . . 0.0 110.131 -177.305 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 46.7 t -138.96 97.75 3.38 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 123.835 0.854 . . . . 0.0 110.825 -174.094 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -86.11 99.67 11.66 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 107.275 -1.38 . . . . 0.0 107.275 167.414 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -123.65 -178.29 3.99 Favored 'General case' 0 CA--C 1.553 1.088 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.519 -166.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.453 ' O ' HG13 ' A' ' 19' ' ' ILE . 4.9 m-20 -77.83 40.53 0.32 Allowed 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 124.917 1.287 . . . . 0.0 111.592 -177.616 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.532 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 74.4 mt -67.28 135.48 53.42 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.783 0.833 . . . . 0.0 112.106 -167.319 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 52.5 t -57.2 114.93 9.09 Favored Pre-proline 0 CA--C 1.55 0.952 0 O-C-N 124.308 1.005 . . . . 0.0 108.868 174.143 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -57.35 -19.84 37.13 Favored 'Trans proline' 0 N--CA 1.508 2.361 0 C-N-CA 123.373 2.716 . . . . 0.0 114.185 -175.172 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.8 mp -80.02 -26.76 12.04 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.468 0 C-N-CA 124.269 1.028 . . . . 0.0 110.774 -176.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 40.4 m -133.33 -42.06 0.87 Allowed 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 113.256 0.836 . . . . 0.0 113.256 -161.162 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 93.1 m-85 77.94 -37.64 0.24 Allowed 'General case' 0 N--CA 1.496 1.846 0 C-N-CA 126.248 1.819 . . . . 0.0 113.108 178.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -74.59 -6.95 51.44 Favored 'General case' 0 CA--C 1.555 1.156 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 -169.032 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 66.9 m-70 -141.49 137.72 16.74 Favored Pre-proline 0 N--CA 1.494 1.734 0 CA-C-N 118.658 0.663 . . . . 0.0 109.936 174.634 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.532 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 47.2 Cg_endo -88.62 80.69 0.94 Allowed 'Trans proline' 0 C--N 1.383 2.355 0 C-N-CA 123.429 2.753 . . . . 0.0 114.027 -178.725 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.453 HG13 ' O ' ' A' ' 9' ' ' ASP . 64.7 mt 63.07 155.5 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.037 0 C-N-CA 124.948 1.299 . . . . 0.0 111.957 -178.945 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 26.3 t -159.81 -7.6 0.06 Allowed 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 122.696 0.398 . . . . 0.0 111.766 173.126 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -152.03 132.52 13.83 Favored 'General case' 0 N--CA 1.481 1.083 0 CA-C-N 118.348 0.522 . . . . 0.0 111.144 -175.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.2 p -102.41 132.89 47.53 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.88 0 C-N-CA 124.231 1.013 . . . . 0.0 109.834 173.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -93.71 100.11 12.39 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.118 -178.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 -90.02 151.47 45.14 Favored Pre-proline 0 CA--C 1.545 0.759 0 C-N-CA 123.61 0.764 . . . . 0.0 110.92 178.07 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_endo -92.44 32.21 10.7 Favored 'Cis proline' 0 C--N 1.376 2.011 0 CA-C-N 118.528 0.51 . . . . 0.0 113.112 3.436 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.7 t -83.49 -72.83 0.44 Allowed 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 122.67 0.388 . . . . 0.0 111.246 -179.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 133.67 -30.4 2.99 Favored Glycine 0 C--N 1.349 1.254 0 CA-C-O 119.696 -0.502 . . . . 0.0 112.674 -176.028 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 20.1 m170 -57.29 132.3 52.62 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 123.385 0.674 . . . . 0.0 110.717 175.536 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 50.3 mttp -115.52 150.66 36.2 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.152 0.981 . . . . 0.0 110.44 -175.847 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 54.5 p -142.13 -155.94 0.64 Allowed 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 166.168 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 22.3 p -99.41 162.09 13.24 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 118.312 0.506 . . . . 0.0 109.79 173.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -63.58 -34.6 78.18 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.029 0.932 . . . . 0.0 111.282 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.87 -32.51 70.78 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.42 0.688 . . . . 0.0 111.584 176.761 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.4 m -63.52 -55.39 24.35 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.507 0.723 . . . . 0.0 111.07 176.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.622 HG12 HG23 ' A' ' 55' ' ' VAL . 8.8 tp -69.75 -37.74 74.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 O-C-N 123.579 0.549 . . . . 0.0 110.95 -173.491 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -63.47 -38.44 91.15 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-O 121.134 0.492 . . . . 0.0 110.683 178.561 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -73.18 -32.69 64.98 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 123.538 0.735 . . . . 0.0 110.675 175.423 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 59.8 t60 -72.94 -32.5 65.32 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.86 0.864 . . . . 0.0 110.713 -176.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 97.4 mt -72.39 -7.42 49.6 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.864 0.866 . . . . 0.0 111.9 -179.072 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 92.9 mmm -74.31 -14.11 60.85 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 123.657 0.783 . . . . 0.0 110.851 168.315 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 19.1 t30 -131.37 -73.17 0.53 Allowed 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 124.131 0.972 . . . . 0.0 111.064 -175.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -126.79 -170.07 2.14 Favored 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 123.695 0.798 . . . . 0.0 111.177 -176.152 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -145.34 35.36 1.08 Allowed 'General case' 0 N--CA 1.476 0.825 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 176.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.507 ' HA ' ' HA ' ' A' ' 51' ' ' THR . 4.5 m-20 -99.16 156.82 16.76 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.144 -177.16 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.427 ' HB2' ' O ' ' A' ' 50' ' ' THR . 5.4 t -72.01 115.66 11.5 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 86.9 m-85 -49.42 -34.66 17.02 Favored 'General case' 0 N--CA 1.495 1.823 0 C-N-CA 123.989 0.916 . . . . 0.0 112.866 -177.175 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 77.6 m-85 -91.7 -28.04 17.69 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 115.2 -0.909 . . . . 0.0 112.777 -169.617 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 7.8 p -149.61 22.72 0.9 Allowed 'General case' 0 N--CA 1.496 1.857 0 N-CA-C 113.316 0.858 . . . . 0.0 113.316 -169.155 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 65.7 mttm 71.24 -28.22 0.18 Allowed 'General case' 0 N--CA 1.505 2.277 0 N-CA-C 115.671 1.73 . . . . 0.0 115.671 172.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.427 ' O ' ' HB2' ' A' ' 45' ' ' CYS . 7.7 m -57.43 114.25 2.13 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.75 0.82 . . . . 0.0 112.268 -169.483 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.507 ' HA ' ' HA ' ' A' ' 44' ' ' ASP . 24.8 m -57.48 123.67 16.3 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 123.369 0.668 . . . . 0.0 110.508 -179.63 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.508 HG21 HG22 ' A' ' 55' ' ' VAL . 12.2 mt -71.97 122.57 24.59 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 124.86 1.264 . . . . 0.0 109.515 -175.75 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 83.9 t -81.39 -34.31 13.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 C-N-CA 122.968 0.507 . . . . 0.0 109.842 178.43 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 24.5 t -156.29 135.7 12.28 Favored 'General case' 0 C--N 1.355 0.828 0 CA-C-O 120.935 0.397 . . . . 0.0 110.596 -179.058 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.622 HG23 HG12 ' A' ' 35' ' ' ILE . 31.6 t -108.83 106.78 21.35 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 123.682 0.793 . . . . 0.0 109.881 179.871 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -93.39 141.92 27.91 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 173.45 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -79.24 118.56 21.29 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 173.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 74.1 t90 -84.5 105.77 15.57 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 -175.551 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -85.71 131.98 34.23 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 170.668 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -75.28 155.51 36.61 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.332 0.653 . . . . 0.0 110.834 177.509 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.16 0 CA-C-O 118.986 -0.897 . . . . 0.0 111.156 179.001 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 40.2 m . . . . . 0 N--CA 1.482 1.148 0 CA-C-O 120.359 0.123 . . . . 0.0 111.275 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 83.9 t60 -120.81 91.21 3.48 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.356 0.662 . . . . 0.0 109.624 175.41 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 59.9 mtm -146.62 76.36 11.85 Favored Pre-proline 0 N--CA 1.477 0.896 0 C-N-CA 124.953 1.301 . . . . 0.0 107.684 167.498 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -90.42 17.96 1.41 Allowed 'Trans proline' 0 C--N 1.381 2.257 0 C-N-CA 123.144 2.563 . . . . 0.0 112.035 178.599 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 9.8 t -139.17 155.26 47.96 Favored 'General case' 0 C--O 1.245 0.818 0 C-N-CA 124.599 1.159 . . . . 0.0 109.336 -178.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 25.9 t -78.75 100.37 7.07 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.108 178.221 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.453 ' HG3' ' HG2' ' A' ' 8' ' ' GLU . 8.9 pt-20 -47.6 -60.97 2.17 Favored 'General case' 0 CA--C 1.554 1.127 0 C-N-CA 125.404 1.481 . . . . 0.0 114.296 -172.046 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.453 ' HG2' ' HG3' ' A' ' 7' ' ' GLU . 14.9 mm-40 -96.63 15.86 20.53 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 123.432 0.693 . . . . 0.0 110.318 -174.785 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 54.9 51.99 12.7 Favored 'General case' 0 C--N 1.353 0.742 0 CA-C-O 122.238 1.018 . . . . 0.0 109.15 -164.296 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.63 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 88.0 mt -71.71 145.83 48.58 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 113.568 -1.651 . . . . 0.0 109.716 175.827 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.599 ' SG ' ' HB2' ' A' ' 30' ' ' SER . 45.2 t -59.3 118.26 28.98 Favored Pre-proline 0 CA--C 1.548 0.899 0 CA-C-O 118.357 -0.83 . . . . 0.0 108.901 173.251 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_endo -60.55 -17.37 48.18 Favored 'Trans proline' 0 N--CA 1.507 2.3 0 C-N-CA 123.111 2.54 . . . . 0.0 112.848 -176.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 67.8 mt -86.53 -46.2 16.55 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.871 0 C-N-CA 124.925 1.29 . . . . 0.0 111.628 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 91.9 m -92.66 -38.39 11.88 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.253 0.621 . . . . 0.0 111.564 -170.357 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.423 ' O ' HD12 ' A' ' 10' ' ' LEU . 98.1 m-85 74.69 -44.64 0.56 Allowed 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 126.232 1.813 . . . . 0.0 112.976 179.56 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -76.76 -32.49 57.76 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.268 0.627 . . . . 0.0 112.667 -175.517 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 15.6 m-70 -112.64 153.28 45.06 Favored Pre-proline 0 N--CA 1.481 1.1 0 C-N-CA 123.875 0.87 . . . . 0.0 109.52 -175.475 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.63 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 64.6 Cg_endo -79.05 -170.89 1.1 Allowed 'Trans proline' 0 C--N 1.38 2.213 0 C-N-CA 123.124 2.549 . . . . 0.0 113.9 -174.395 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.456 HG21 ' HB3' ' A' ' 29' ' ' LYS . 97.4 mt -89.99 143.18 11.72 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 CA-C-N 114.792 -1.094 . . . . 0.0 109.968 176.841 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.6 m -142.29 13.42 2.0 Allowed 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.079 0.952 . . . . 0.0 110.841 179.698 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -155.78 136.26 13.24 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.711 0.805 . . . . 0.0 110.928 -175.588 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.7 p -122.02 126.99 75.2 Favored 'Isoleucine or valine' 0 C--O 1.24 0.564 0 C-N-CA 124.605 1.162 . . . . 0.0 108.45 172.329 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -92.98 88.65 6.22 Favored 'General case' 0 C--O 1.244 0.789 0 N-CA-C 108.133 -1.062 . . . . 0.0 108.133 -178.281 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -71.56 152.35 93.77 Favored Pre-proline 0 C--O 1.242 0.704 0 CA-C-N 114.035 -1.438 . . . . 0.0 111.863 -177.506 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_endo -92.48 28.9 15.83 Favored 'Cis proline' 0 C--N 1.375 1.955 0 C-N-CA 125.783 -0.507 . . . . 0.0 112.616 -9.43 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 53.6 t -77.24 -40.31 45.33 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.258 0.623 . . . . 0.0 111.551 -176.022 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 91.73 -6.34 79.79 Favored Glycine 0 C--N 1.343 0.942 0 CA-C-O 119.37 -0.683 . . . . 0.0 114.369 179.168 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.496 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 13.5 m170 -64.95 135.51 55.75 Favored 'General case' 0 N--CA 1.481 1.084 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 167.127 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.456 ' HB3' HG21 ' A' ' 19' ' ' ILE . 86.5 mttt -136.09 151.24 49.61 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.391 0.676 . . . . 0.0 110.644 -171.126 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.599 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 92.7 p -161.9 -173.93 3.92 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.486 1.114 . . . . 0.0 108.389 172.272 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 15.8 p -75.06 145.95 41.92 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 174.308 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -67.56 -19.81 65.32 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 122.951 0.5 . . . . 0.0 111.957 -173.456 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.78 -39.53 85.21 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 123.744 0.818 . . . . 0.0 111.536 171.408 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.8 m -61.74 -49.02 78.08 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.608 0.763 . . . . 0.0 111.721 178.364 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.502 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 9.7 tp -72.14 -36.68 57.24 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 O-C-N 123.116 0.26 . . . . 0.0 111.101 -173.36 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -64.11 -38.66 91.87 Favored 'General case' 0 CA--C 1.549 0.937 0 CA-C-O 121.126 0.488 . . . . 0.0 109.843 177.611 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.493 ' O ' ' HG2' ' A' ' 40' ' ' MET . 45.9 tt0 -69.75 -27.98 65.4 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 123.961 0.905 . . . . 0.0 110.767 173.661 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 78.3 t60 -83.59 -26.57 29.9 Favored 'General case' 0 C--O 1.21 -1.007 0 C-N-CA 123.281 0.632 . . . . 0.0 111.292 -177.303 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.566 HD21 ' HG3' ' A' ' 43' ' ' LYS . 88.0 mt -69.01 -30.77 69.24 Favored 'General case' 0 N--CA 1.486 1.338 0 CA-C-N 118.314 0.506 . . . . 0.0 111.328 -177.479 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.493 ' HG2' ' O ' ' A' ' 37' ' ' GLN . 25.1 ptt? -68.28 -21.03 64.81 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 122.402 0.281 . . . . 0.0 110.53 173.871 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.425 ' ND2' HD21 ' A' ' 42' ' ' ASN . 6.6 t30 -88.3 -75.81 0.41 Allowed 'General case' 0 CA--C 1.558 1.279 0 C-N-CA 124.435 1.094 . . . . 0.0 109.412 175.34 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.425 HD21 ' ND2' ' A' ' 41' ' ' ASN . 48.4 m-80 -148.35 151.56 35.55 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 124.778 1.231 . . . . 0.0 109.673 178.162 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.566 ' HG3' HD21 ' A' ' 39' ' ' LEU . 13.5 mptt -90.63 62.04 5.03 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.592 0.757 . . . . 0.0 110.176 179.709 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -130.16 174.49 9.76 Favored 'General case' 0 N--CA 1.481 1.102 0 CA-C-O 121.423 0.63 . . . . 0.0 110.953 179.221 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.496 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 41.8 t -98.49 45.87 1.01 Allowed 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.63 1.172 . . . . 0.0 110.86 -172.45 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 57.39 -87.31 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 125.651 1.58 . . . . 0.0 113.031 172.092 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 73.0 m-85 -75.27 -37.34 60.97 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.923 1.289 . . . . 0.0 111.572 -165.288 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.426 ' SG ' ' OG1' ' A' ' 50' ' ' THR . 13.8 p -110.12 -9.43 14.71 Favored 'General case' 0 N--CA 1.482 1.153 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.432 -172.372 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 99.0 mttt 60.57 30.55 19.83 Favored 'General case' 0 N--CA 1.492 1.626 0 C-N-CA 124.502 1.121 . . . . 0.0 113.74 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.426 ' OG1' ' SG ' ' A' ' 48' ' ' CYS . 74.4 m -65.97 127.64 32.89 Favored 'General case' 0 N--CA 1.481 1.117 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 169.358 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 9.0 m -59.57 123.19 16.07 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 109.611 -0.515 . . . . 0.0 109.611 176.79 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 36.4 mm -59.51 105.7 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.929 0 O-C-N 123.757 0.661 . . . . 0.0 110.725 -176.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 35.4 t -79.28 -46.08 23.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 175.474 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 30.0 p -160.24 138.78 10.31 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.171 0.588 . . . . 0.0 111.071 176.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.476 HG13 HG23 ' A' ' 35' ' ' ILE . 65.4 t -106.66 108.5 25.31 Favored 'Isoleucine or valine' 0 C--O 1.243 0.722 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 170.564 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -104.12 147.38 27.49 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 123.322 0.649 . . . . 0.0 109.798 178.657 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -69.46 96.8 0.93 Allowed 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 178.043 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 63.4 t90 -72.43 110.44 6.83 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 -178.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -80.32 143.72 33.37 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 115.006 -0.997 . . . . 0.0 109.348 173.267 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.63 ' HB2' ' HZ3' ' A' ' 60' ' ' LYS . 0.0 OUTLIER -103.89 3.34 33.61 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 124.014 0.925 . . . . 0.0 111.266 -179.737 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.22 0 CA-C-O 119.534 -0.592 . . . . 0.0 112.164 -176.564 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.675 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 93.8 mt . . . . . 0 CA--C 1.539 0.532 0 CA-C-O 120.355 0.121 . . . . 0.0 110.903 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.525 ' SG ' ' HB2' ' A' ' 30' ' ' SER . 42.0 t -49.71 111.62 2.16 Favored Pre-proline 0 CA--C 1.547 0.862 0 C-N-CA 124.753 1.221 . . . . 0.0 110.211 179.589 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -62.44 -21.41 72.72 Favored 'Trans proline' 0 C--N 1.378 2.089 0 C-N-CA 123.22 2.614 . . . . 0.0 113.661 -171.771 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 64.9 mt -68.41 -27.54 37.07 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.153 0 C-N-CA 124.064 0.946 . . . . 0.0 111.411 176.573 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 64.6 m -125.75 -32.85 2.8 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 -164.215 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 68.03 -47.02 0.52 Allowed 'General case' 0 N--CA 1.495 1.799 0 C-N-CA 125.807 1.643 . . . . 0.0 114.068 -173.006 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -66.52 -37.76 85.73 Favored 'General case' 0 CA--C 1.55 0.946 0 N-CA-C 113.677 0.991 . . . . 0.0 113.677 -168.635 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 20.8 m-70 -118.77 150.88 49.25 Favored Pre-proline 0 N--CA 1.491 1.6 0 C-N-CA 123.58 0.752 . . . . 0.0 109.85 -176.841 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.675 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 43.9 Cg_endo -84.26 -173.35 1.51 Allowed 'Trans proline' 0 C--N 1.379 2.134 0 C-N-CA 123.042 2.495 . . . . 0.0 113.42 -178.116 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 82.8 mt -80.31 142.54 13.76 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.794 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.349 176.419 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.487 ' HB3' ' HG3' ' A' ' 32' ' ' LYS . 23.1 t -150.17 -4.01 0.36 Allowed 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 123.236 0.614 . . . . 0.0 111.692 177.803 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -137.64 132.4 32.93 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.017 0.527 . . . . 0.0 110.725 -175.104 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 12.9 p -106.05 145.85 13.47 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 C-N-CA 124.621 1.168 . . . . 0.0 109.6 174.029 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 19.7 m-85 -112.59 88.27 2.78 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.694 0.798 . . . . 0.0 109.496 -175.304 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 51.0 mt-30 -75.82 155.83 84.81 Favored Pre-proline 0 C--O 1.243 0.737 0 C-N-CA 124.078 0.951 . . . . 0.0 111.824 -176.531 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -82.32 2.21 50.62 Favored 'Cis proline' 0 N--CA 1.508 2.333 0 N-CA-C 114.585 0.956 . . . . 0.0 114.585 -2.889 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 41.5 t -64.44 -49.65 70.62 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.303 0.641 . . . . 0.0 112.308 -177.212 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 101.65 -3.1 53.14 Favored Glycine 0 CA--C 1.529 0.955 0 CA-C-O 118.47 -1.183 . . . . 0.0 114.691 178.196 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.604 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 8.6 m-70 -62.74 145.04 55.75 Favored 'General case' 0 N--CA 1.492 1.67 0 CA-C-N 118.493 1.146 . . . . 0.0 110.01 175.569 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 50.8 mttp -133.34 147.91 51.85 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 122.738 0.415 . . . . 0.0 111.254 -169.254 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.525 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 88.1 p -161.19 -169.7 2.42 Favored 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 124.105 0.962 . . . . 0.0 108.971 174.045 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 17.7 p -74.42 151.96 39.56 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 122.561 0.345 . . . . 0.0 110.372 177.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.487 ' HG3' ' HB3' ' A' ' 20' ' ' SER . 28.0 mtpp -58.69 -37.77 76.8 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.141 0.576 . . . . 0.0 111.439 179.057 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -58.3 -28.64 65.2 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.51 0.724 . . . . 0.0 112.68 178.707 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.2 m -59.54 -62.15 2.09 Favored 'General case' 0 N--CA 1.483 1.18 0 O-C-N 123.747 0.655 . . . . 0.0 110.89 177.276 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.687 HG12 HG21 ' A' ' 55' ' ' VAL . 7.3 tp -66.76 -41.06 87.38 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 O-C-N 123.8 0.688 . . . . 0.0 111.447 -172.371 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -58.53 -43.65 89.3 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 122.808 0.443 . . . . 0.0 110.816 179.555 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -71.77 -34.84 69.8 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.39 0.676 . . . . 0.0 109.893 176.975 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 74.9 t60 -70.98 -28.57 64.54 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.288 1.035 . . . . 0.0 111.097 -176.47 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 94.7 mt -70.61 -11.25 60.82 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.426 0.69 . . . . 0.0 111.632 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 30.8 mmt -82.15 -14.27 55.94 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.941 0.896 . . . . 0.0 110.931 172.742 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 -116.09 -74.19 0.62 Allowed 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.699 1.2 . . . . 0.0 109.783 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 79.0 m-20 -125.28 -168.09 1.78 Allowed 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 124.528 1.131 . . . . 0.0 110.9 -176.717 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -134.66 24.59 3.7 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 124.312 1.045 . . . . 0.0 109.512 171.291 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -87.57 165.1 15.71 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-O 121.326 0.584 . . . . 0.0 111.85 -175.572 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.604 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 43.5 t -94.19 36.15 1.15 Allowed 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.813 1.245 . . . . 0.0 112.086 -169.557 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 54.16 -82.39 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 125.429 1.492 . . . . 0.0 113.197 169.052 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 41.6 m-85 -70.71 -11.99 61.28 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.119 1.368 . . . . 0.0 113.071 -169.743 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 15.3 p -143.14 -7.13 0.81 Allowed 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 122.87 0.468 . . . . 0.0 111.638 178.395 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 52.1 tttm 63.03 22.79 13.65 Favored 'General case' 0 CA--C 1.569 1.676 0 C-N-CA 124.496 1.118 . . . . 0.0 113.124 176.292 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 56.0 m -73.13 151.84 41.42 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.216 0.607 . . . . 0.0 110.625 174.173 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 56.6 m -63.43 120.5 11.77 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 122.605 0.362 . . . . 0.0 110.373 174.794 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.48 HG21 HG22 ' A' ' 55' ' ' VAL . 49.5 mt -79.9 111.38 16.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 172.681 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 87.2 t -75.57 -46.04 37.89 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 O-C-N 123.452 0.47 . . . . 0.0 109.75 176.587 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.5 m -141.91 134.4 28.16 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 122.828 0.451 . . . . 0.0 110.677 -179.268 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.687 HG21 HG12 ' A' ' 35' ' ' ILE . 41.6 t -102.3 104.12 16.01 Favored 'Isoleucine or valine' 0 C--O 1.244 0.781 0 C-N-CA 123.776 0.831 . . . . 0.0 108.888 172.865 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 52.8 mm-40 -105.0 156.78 17.72 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 109.843 -0.429 . . . . 0.0 109.843 179.866 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -78.79 108.11 11.99 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.319 175.876 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 53.2 t90 . . . . . 0 CA--C 1.542 0.648 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 175.346 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.703 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 58.9 mt . . . . . 0 N--CA 1.47 0.535 0 CA-C-O 121.047 0.451 . . . . 0.0 111.856 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 42.6 t -61.33 118.98 42.12 Favored Pre-proline 0 CA--C 1.549 0.936 0 CA-C-N 115.041 -0.981 . . . . 0.0 109.705 177.19 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -71.07 -3.58 13.14 Favored 'Trans proline' 0 C--N 1.379 2.182 0 C-N-CA 123.082 2.521 . . . . 0.0 113.498 -175.407 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 61.1 mt -91.95 -22.69 5.95 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.311 0 C-N-CA 124.367 1.067 . . . . 0.0 110.529 177.376 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 71.2 m -124.75 -51.38 1.71 Allowed 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.257 0.623 . . . . 0.0 112.073 -167.033 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 90.8 m-85 71.69 -8.83 1.02 Allowed 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 125.669 1.588 . . . . 0.0 113.587 179.528 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -100.4 -14.22 18.42 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 118.962 0.801 . . . . 0.0 111.513 179.022 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 85.2 m-70 -138.68 149.45 62.37 Favored Pre-proline 0 N--CA 1.485 1.296 0 C-N-CA 123.403 0.681 . . . . 0.0 109.74 177.731 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.703 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 64.2 Cg_endo -68.95 174.33 8.95 Favored 'Trans proline' 0 C--N 1.383 2.392 0 C-N-CA 123.422 2.748 . . . . 0.0 114.572 -177.429 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 73.2 mt -72.7 127.78 34.98 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 N-CA-C 107.718 -1.215 . . . . 0.0 107.718 167.802 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 51.5 p -142.65 15.27 1.97 Allowed 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.191 0.596 . . . . 0.0 111.531 -174.358 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -154.82 149.34 26.32 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.544 0.738 . . . . 0.0 110.242 -176.821 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.7 p -140.69 126.53 20.23 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 175.607 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -87.16 104.73 16.64 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.905 0.882 . . . . 0.0 109.429 -172.513 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -100.63 142.91 25.53 Favored Pre-proline 0 CA--C 1.556 1.186 0 C-N-CA 123.972 0.909 . . . . 0.0 109.587 -175.009 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.46 ' HD3' ' HB ' ' A' ' 53' ' ' VAL . 85.8 Cg_endo -96.31 89.88 0.12 OUTLIER 'Cis proline' 0 C--N 1.382 2.29 0 CA-C-N 120.073 1.062 . . . . 0.0 112.411 -1.764 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 47.8 t -142.95 -39.84 0.33 Allowed 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 116.095 -0.502 . . . . 0.0 112.056 173.586 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 100.88 -16.28 57.55 Favored Glycine 0 C--N 1.349 1.269 0 CA-C-O 118.96 -0.911 . . . . 0.0 114.339 175.584 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.584 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 22.6 m-70 -59.77 134.18 56.79 Favored 'General case' 0 N--CA 1.489 1.507 0 CA-C-N 117.789 0.795 . . . . 0.0 110.266 174.865 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -116.57 160.23 20.96 Favored 'General case' 0 C--O 1.238 0.471 0 C-N-CA 123.814 0.846 . . . . 0.0 111.039 -173.405 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 45.2 t -174.4 -176.19 1.06 Allowed 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.292 1.437 . . . . 0.0 108.57 -177.295 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 16.1 p -89.75 151.4 21.85 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 173.944 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.1 -25.16 67.97 Favored 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -178.269 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.2 -41.55 88.82 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.489 0.716 . . . . 0.0 111.499 174.491 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.7 m -56.87 -56.6 19.5 Favored 'General case' 0 N--CA 1.477 0.92 0 O-C-N 124.255 0.972 . . . . 0.0 111.109 178.26 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.541 HG12 HG21 ' A' ' 55' ' ' VAL . 8.0 tp -69.41 -38.97 78.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 O-C-N 123.578 0.549 . . . . 0.0 110.8 -171.624 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 86.6 m-20 -62.93 -37.64 87.83 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 122.728 0.411 . . . . 0.0 110.992 176.563 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 63.8 tt0 -70.81 -34.17 71.45 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.187 0.595 . . . . 0.0 110.737 175.422 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 33.0 t60 -70.21 -34.71 73.24 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.743 0.817 . . . . 0.0 109.936 179.123 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 98.1 mt -72.83 -7.53 51.22 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.956 0.902 . . . . 0.0 111.798 -179.3 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 94.1 mmm -79.26 -16.96 55.63 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.47 0.708 . . . . 0.0 110.809 170.299 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 64.9 m-20 -116.9 -73.58 0.64 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.814 0.846 . . . . 0.0 109.644 -179.031 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -125.39 -167.26 1.66 Allowed 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 124.718 1.207 . . . . 0.0 110.328 -175.712 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 89.0 tttt -142.13 81.46 1.75 Allowed 'General case' 0 N--CA 1.476 0.866 0 CA-C-O 121.393 0.616 . . . . 0.0 109.808 178.886 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.45 ' HB3' ' HA ' ' A' ' 49' ' ' LYS . 15.2 m-20 -136.1 166.26 23.8 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-O 121.946 0.879 . . . . 0.0 110.89 -173.735 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.584 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 41.9 t -92.9 29.68 1.76 Allowed 'General case' 0 N--CA 1.48 1.034 0 CA-C-N 113.818 -1.537 . . . . 0.0 110.564 178.894 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 63.4 -85.69 0.02 OUTLIER 'General case' 0 C--N 1.358 0.953 0 C-N-CA 125.197 1.399 . . . . 0.0 112.698 172.585 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 43.8 m-85 -64.2 -51.82 61.88 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.579 1.152 . . . . 0.0 111.014 -166.988 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 20.2 p -93.19 -11.8 31.85 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.561 -178.351 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.45 ' HA ' ' HB3' ' A' ' 44' ' ' ASP . 0.1 OUTLIER 61.21 27.51 17.24 Favored 'General case' 0 N--CA 1.495 1.797 0 C-N-CA 124.987 1.315 . . . . 0.0 113.26 -176.452 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 85.5 m -65.42 118.91 10.08 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.039 0.535 . . . . 0.0 109.625 169.997 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 85.3 m -56.1 129.29 39.36 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.313 0.645 . . . . 0.0 110.528 179.218 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.425 HG13 HD11 ' A' ' 35' ' ' ILE . 40.2 mm -63.7 126.09 21.61 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.775 0 C-N-CA 122.971 0.508 . . . . 0.0 111.48 -174.642 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.46 ' HB ' ' HD3' ' A' ' 25' ' ' PRO . 60.9 t -97.67 -42.9 11.9 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 169.434 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.1 t -153.9 151.95 30.05 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.927 0.891 . . . . 0.0 110.255 177.3 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.541 HG21 HG12 ' A' ' 35' ' ' ILE . 43.1 t -124.5 122.44 63.9 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 169.83 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -93.04 150.98 20.15 Favored 'General case' 0 C--O 1.242 0.671 0 C-N-CA 122.881 0.472 . . . . 0.0 110.679 179.682 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -76.02 95.85 3.68 Favored 'General case' 0 C--O 1.242 0.704 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 172.675 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 61.4 t90 . . . . . 0 CA--C 1.54 0.584 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 -177.823 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.589 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 96.9 mt . . . . . 0 C--O 1.235 0.319 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.549 ' SG ' ' HB2' ' A' ' 30' ' ' SER . 47.5 t -62.58 113.22 8.29 Favored Pre-proline 0 CA--C 1.538 0.486 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 169.889 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -58.73 -20.29 50.43 Favored 'Trans proline' 0 C--N 1.373 1.821 0 C-N-CA 122.921 2.414 . . . . 0.0 113.894 -172.07 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.8 mp -80.93 -49.7 17.89 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.159 0 C-N-CA 123.686 0.795 . . . . 0.0 110.393 176.364 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 95.8 m -79.84 -47.57 14.93 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.23 0.612 . . . . 0.0 112.469 -170.179 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 74.66 -37.96 0.37 Allowed 'General case' 0 N--CA 1.497 1.878 0 C-N-CA 126.076 1.751 . . . . 0.0 113.14 -174.592 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -91.2 0.47 57.52 Favored 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 112.914 0.709 . . . . 0.0 112.914 -175.357 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 92.1 m-70 -146.63 151.33 42.58 Favored Pre-proline 0 N--CA 1.49 1.539 0 C-N-CA 123.833 0.853 . . . . 0.0 108.812 177.904 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.589 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 78.7 Cg_endo -77.49 -169.8 0.82 Allowed 'Trans proline' 0 C--N 1.378 2.087 0 C-N-CA 123.528 2.819 . . . . 0.0 114.275 -175.939 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 84.8 mt -85.94 155.12 3.42 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.346 0 C-N-CA 124.685 1.194 . . . . 0.0 110.732 177.964 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 34.8 t -141.56 -10.96 0.92 Allowed 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 124.049 0.94 . . . . 0.0 111.511 177.478 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -149.94 146.73 27.22 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.094 0.558 . . . . 0.0 111.605 -170.453 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.6 p -111.66 141.03 28.34 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 124.293 1.037 . . . . 0.0 110.22 175.011 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.47 ' HZ ' ' HG ' ' A' ' 30' ' ' SER . 17.7 m-85 -97.72 96.16 8.06 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.647 0.779 . . . . 0.0 108.957 176.971 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 36.3 mt-30 -90.26 148.83 40.06 Favored Pre-proline 0 CA--C 1.543 0.698 0 C-N-CA 123.344 0.658 . . . . 0.0 110.983 -179.273 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -88.18 13.92 50.0 Favored 'Cis proline' 0 C--N 1.38 2.197 0 N-CA-C 114.606 0.964 . . . . 0.0 114.606 4.473 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 52.2 t -67.08 -70.41 0.25 Allowed 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -173.025 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 130.4 -24.2 4.45 Favored Glycine 0 C--N 1.347 1.172 0 CA-C-O 119.487 -0.618 . . . . 0.0 113.052 -177.096 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.565 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 25.6 m170 -61.29 145.77 50.26 Favored 'General case' 0 N--CA 1.486 1.363 0 CA-C-N 117.427 0.613 . . . . 0.0 110.168 171.546 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 60.4 mttp -136.82 161.32 36.32 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.404 0.682 . . . . 0.0 111.001 -171.127 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.549 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 51.3 p -165.41 -174.47 3.19 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.201 1.0 . . . . 0.0 108.99 173.153 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 17.4 p -79.17 156.35 28.25 Favored 'General case' 0 C--O 1.246 0.898 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 173.133 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -64.41 -26.61 68.53 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.302 0.641 . . . . 0.0 112.302 -177.563 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.37 -35.35 77.21 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.063 0.545 . . . . 0.0 111.937 176.581 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 17.6 m -69.28 -43.73 73.3 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.306 0.642 . . . . 0.0 111.564 179.031 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.548 HG12 HG21 ' A' ' 55' ' ' VAL . 9.8 tp -75.96 -31.73 22.43 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 CA-C-O 119.662 -0.209 . . . . 0.0 110.928 -177.806 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 58.6 t30 -61.25 -44.81 96.63 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 174.106 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 42.6 tt0 -58.46 -44.0 89.11 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 124.76 1.224 . . . . 0.0 110.907 173.004 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 49.4 t60 -71.69 -35.22 70.19 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.492 -172.913 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.436 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 90.6 mt -69.61 -11.91 61.21 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.397 0.679 . . . . 0.0 112.126 -178.267 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 19.3 mmt -78.56 -14.89 59.11 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 123.87 0.868 . . . . 0.0 110.585 173.016 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 21.1 m-80 -115.98 -75.84 0.58 Allowed 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.505 1.122 . . . . 0.0 109.416 -178.213 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 49.4 m-80 -132.22 -170.93 2.52 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 124.319 1.047 . . . . 0.0 110.01 -176.539 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -132.68 29.41 4.18 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 123.379 0.672 . . . . 0.0 110.025 177.598 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.424 ' HA ' ' HA ' ' A' ' 51' ' ' THR . 23.8 m-20 -89.76 161.11 16.21 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.748 0.819 . . . . 0.0 110.992 178.477 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.565 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 40.8 t -91.7 60.43 3.97 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.195 0.598 . . . . 0.0 111.762 -175.58 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 36.0 m-85 47.71 -90.84 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 126.183 1.793 . . . . 0.0 113.922 168.927 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 -73.51 -56.84 4.51 Favored 'General case' 0 C--N 1.354 0.804 0 C-N-CA 123.775 0.83 . . . . 0.0 110.879 -169.411 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 13.1 p -77.83 -20.39 53.24 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.857 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 1.2 tmtp? 69.29 1.46 3.27 Favored 'General case' 0 CA--C 1.564 1.514 0 C-N-CA 125.133 1.373 . . . . 0.0 113.433 176.665 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 29.1 m -56.79 120.98 8.78 Favored 'General case' 0 CA--C 1.551 1.006 0 O-C-N 121.593 -0.692 . . . . 0.0 110.041 175.438 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.424 ' HA ' ' HA ' ' A' ' 44' ' ' ASP . 21.4 m -59.98 129.25 40.87 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.16 0.584 . . . . 0.0 111.053 -174.901 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.526 HG21 HG22 ' A' ' 55' ' ' VAL . 17.1 mt -81.62 127.75 39.31 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 C-N-CA 124.052 0.941 . . . . 0.0 109.552 -175.129 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 78.0 t -74.97 -50.61 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 N-CA-C 109.273 -0.639 . . . . 0.0 109.273 173.921 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 33.0 t -147.4 134.67 20.6 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.214 -179.3 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.548 HG21 HG12 ' A' ' 35' ' ' ILE . 44.2 t -98.87 103.03 14.19 Favored 'Isoleucine or valine' 0 C--O 1.239 0.526 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 175.073 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -91.91 169.17 10.89 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 177.091 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -82.49 150.28 27.1 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 170.755 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 81.6 t90 . . . . . 0 C--O 1.243 0.756 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 173.653 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.675 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 96.6 mt . . . . . 0 C--O 1.237 0.399 0 CA-C-O 120.52 0.2 . . . . 0.0 110.471 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 35.4 t -61.74 116.34 20.39 Favored Pre-proline 0 CA--C 1.545 0.762 0 O-C-N 124.032 0.832 . . . . 0.0 108.952 172.436 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -64.95 -7.66 15.82 Favored 'Trans proline' 0 C--N 1.373 1.849 0 C-N-CA 123.029 2.486 . . . . 0.0 113.476 -172.966 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.3 mp -90.93 -54.09 7.97 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.151 0 C-N-CA 124.096 0.958 . . . . 0.0 109.436 172.05 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 70.7 m -83.73 -58.63 2.72 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 122.958 0.503 . . . . 0.0 112.333 -171.006 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.428 ' HA ' ' HB3' ' A' ' 10' ' ' LEU . 92.1 m-85 75.3 -36.23 0.3 Allowed 'General case' 0 N--CA 1.494 1.739 0 C-N-CA 126.243 1.817 . . . . 0.0 111.996 -170.734 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.92 -27.84 67.09 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 124.322 1.049 . . . . 0.0 112.452 178.603 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 42.3 m80 -135.48 154.8 78.65 Favored Pre-proline 0 CA--C 1.557 1.214 0 C-N-CA 124.345 1.058 . . . . 0.0 109.977 176.705 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.675 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 84.7 Cg_endo -73.98 -165.08 0.24 Allowed 'Trans proline' 0 C--N 1.378 2.125 0 C-N-CA 123.361 2.707 . . . . 0.0 114.678 -175.631 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 83.4 mt -84.09 150.24 4.17 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.0 0 C-N-CA 124.139 0.976 . . . . 0.0 110.416 175.346 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.413 ' HB2' ' H ' ' A' ' 32' ' ' LYS . 6.9 m -138.99 -26.54 0.84 Allowed 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.752 0.821 . . . . 0.0 111.317 -178.423 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -139.7 140.08 36.74 Favored 'General case' 0 C--O 1.241 0.644 0 C-N-CA 123.608 0.763 . . . . 0.0 110.386 -174.338 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.6 p -102.89 139.93 22.53 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 C-N-CA 123.923 0.889 . . . . 0.0 109.974 175.774 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 10.4 m-85 -88.25 88.28 7.58 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 176.262 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 62.5 tt0 -85.1 139.68 36.78 Favored Pre-proline 0 CA--C 1.553 1.059 0 CA-C-N 115.067 -0.97 . . . . 0.0 110.208 -172.891 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -95.71 15.16 39.36 Favored 'Cis proline' 0 C--N 1.386 2.519 0 N-CA-C 114.853 1.059 . . . . 0.0 114.853 4.242 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 44.7 t -59.96 -59.74 4.94 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -173.972 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 123.71 -28.89 5.34 Favored Glycine 0 C--N 1.344 0.998 0 CA-C-O 119.299 -0.723 . . . . 0.0 113.035 -177.49 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.537 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 37.6 m-70 -55.26 139.49 42.29 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 171.454 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 57.9 mttp -129.94 170.62 13.71 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 123.294 0.638 . . . . 0.0 110.642 -177.453 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 47.9 t -175.3 177.19 1.9 Allowed 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.846 1.258 . . . . 0.0 108.624 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 14.3 p -77.38 153.57 33.58 Favored 'General case' 0 C--O 1.25 1.13 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 172.695 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.413 ' H ' ' HB2' ' A' ' 20' ' ' SER . 48.4 tttm -65.25 -29.54 70.34 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 123.252 0.621 . . . . 0.0 111.334 -173.893 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -58.54 -43.35 89.23 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.503 0.721 . . . . 0.0 111.49 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 10.9 m -59.27 -51.8 68.42 Favored 'General case' 0 N--CA 1.479 1.021 0 O-C-N 124.029 0.831 . . . . 0.0 111.72 178.457 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.427 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 7.6 tp -73.12 -34.73 45.87 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.779 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.131 -172.92 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -60.7 -43.03 98.29 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 122.523 0.329 . . . . 0.0 110.246 174.106 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 7.3 tp60 -65.72 -34.84 79.14 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.835 175.96 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 57.9 t60 -69.21 -43.15 74.71 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.615 0.766 . . . . 0.0 110.329 -178.865 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 78.7 mt -66.96 -14.54 62.94 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 124.533 1.133 . . . . 0.0 112.118 -176.735 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 96.2 mmm -64.97 -16.21 63.11 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.591 0.757 . . . . 0.0 111.422 172.732 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -133.92 -68.25 0.57 Allowed 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.728 0.811 . . . . 0.0 110.057 174.454 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 88.1 m-20 -106.13 157.12 17.78 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 124.104 0.961 . . . . 0.0 111.088 -172.093 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.42 ' HD2' ' N ' ' A' ' 43' ' ' LYS . 9.4 mptt -115.68 25.36 10.83 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 123.213 0.605 . . . . 0.0 109.457 179.312 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 50.3 m-20 -91.73 163.15 14.18 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 115.439 -0.8 . . . . 0.0 111.841 -172.678 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.537 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 43.5 t -93.19 50.23 1.5 Allowed 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.805 0.842 . . . . 0.0 111.301 -176.894 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 52.44 -84.03 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 125.561 1.544 . . . . 0.0 114.233 170.834 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 90.9 m-85 -73.8 -62.86 1.35 Allowed 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.126 0.97 . . . . 0.0 110.901 -170.012 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 15.9 p -75.59 -18.97 59.57 Favored 'General case' 0 N--CA 1.48 1.057 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.758 179.291 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt 66.83 13.43 9.4 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 125.073 1.349 . . . . 0.0 113.934 176.778 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 29.8 m -66.78 125.15 24.96 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 176.014 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 49.1 m -60.27 121.96 13.29 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-O 120.974 0.416 . . . . 0.0 110.214 -179.174 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 38.0 mt -72.61 133.26 32.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 C-N-CA 124.517 1.127 . . . . 0.0 109.987 -174.234 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 90.8 t -77.75 -41.97 28.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 O-C-N 123.647 0.592 . . . . 0.0 109.654 177.412 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 77.2 p -152.78 134.54 14.63 Favored 'General case' 0 C--O 1.242 0.699 0 C-N-CA 122.76 0.424 . . . . 0.0 110.754 176.356 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 59.8 t -87.7 104.57 14.51 Favored 'Isoleucine or valine' 0 C--O 1.244 0.796 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 170.23 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -103.0 139.46 38.54 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 -172.304 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -70.85 96.15 1.23 Allowed 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.029 0.932 . . . . 0.0 109.502 -178.533 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 88.2 t90 . . . . . 0 C--O 1.24 0.595 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.768 -177.818 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.694 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 96.3 mt . . . . . 0 C--O 1.236 0.39 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 52.1 t -58.61 115.28 11.09 Favored Pre-proline 0 CA--C 1.547 0.841 0 O-C-N 124.234 0.959 . . . . 0.0 109.847 -178.754 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_endo -58.71 -22.22 60.06 Favored 'Trans proline' 0 N--CA 1.502 2.027 0 C-N-CA 123.141 2.561 . . . . 0.0 113.537 -174.38 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 77.3 mt -80.5 -40.03 19.14 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.338 0 C-N-CA 124.115 0.966 . . . . 0.0 111.14 178.313 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 76.5 m -102.72 -54.48 2.64 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 123.616 0.766 . . . . 0.0 111.226 -170.763 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.407 ' O ' HD13 ' A' ' 10' ' ' LEU . 1.7 t80 81.9 -35.87 0.1 Allowed 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 126.616 1.966 . . . . 0.0 111.719 175.36 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.01 -33.63 70.56 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.23 0.612 . . . . 0.0 111.684 179.06 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 41.3 m170 -114.1 150.18 43.18 Favored Pre-proline 0 N--CA 1.483 1.178 0 C-N-CA 123.91 0.884 . . . . 0.0 109.321 179.132 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.694 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 49.4 Cg_endo -79.26 -165.02 0.31 Allowed 'Trans proline' 0 C--N 1.378 2.111 0 C-N-CA 122.924 2.416 . . . . 0.0 113.142 -174.267 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.498 HG21 ' HB3' ' A' ' 29' ' ' LYS . 97.9 mt -86.43 145.09 8.15 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.511 0 C-N-CA 123.946 0.898 . . . . 0.0 109.217 170.889 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.2 m -130.41 -19.99 3.02 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.695 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -137.68 133.77 34.64 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 122.833 0.453 . . . . 0.0 111.91 -168.789 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.7 p -106.57 140.78 23.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 124.833 1.253 . . . . 0.0 109.418 171.638 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -105.47 93.86 4.9 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.07 0.548 . . . . 0.0 110.0 -171.005 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -66.81 144.04 98.36 Favored Pre-proline 0 CA--C 1.547 0.829 0 C-N-CA 123.368 0.667 . . . . 0.0 111.144 175.677 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -85.51 0.25 63.69 Favored 'Cis proline' 0 C--N 1.377 2.035 0 N-CA-C 114.216 0.814 . . . . 0.0 114.216 -1.302 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 51.1 t -64.82 -59.74 3.87 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 -168.174 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 116.73 -16.12 13.99 Favored Glycine 0 C--N 1.346 1.129 0 CA-C-O 119.084 -0.842 . . . . 0.0 114.077 -177.311 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.67 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 9.8 m170 -63.62 161.3 15.05 Favored 'General case' 0 N--CA 1.49 1.558 0 CA-C-N 117.98 0.89 . . . . 0.0 110.515 176.15 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.498 ' HB3' HG21 ' A' ' 19' ' ' ILE . 40.3 mtmt -151.35 144.8 24.85 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 115.401 -0.818 . . . . 0.0 112.615 -161.376 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 59.8 p -156.47 -178.59 7.45 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.324 1.05 . . . . 0.0 109.006 170.545 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 16.8 p -72.05 162.06 30.0 Favored 'General case' 0 C--O 1.247 0.96 0 C-N-CA 122.518 0.327 . . . . 0.0 110.449 178.836 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 32.8 ttmt -55.94 -42.55 76.33 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.316 1.046 . . . . 0.0 110.909 177.982 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -56.7 -44.89 81.98 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.241 1.016 . . . . 0.0 112.465 -176.257 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 32.3 m -61.72 -54.94 35.81 Favored 'General case' 0 N--CA 1.481 1.105 0 O-C-N 123.776 0.673 . . . . 0.0 110.868 179.197 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 9.0 tp -72.54 -28.02 27.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 C-N-CA 122.796 0.438 . . . . 0.0 111.762 -172.5 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 50.4 t-20 -66.54 -51.78 52.8 Favored 'General case' 0 N--CA 1.486 1.325 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 178.545 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -69.41 -26.38 64.6 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 114.946 -1.025 . . . . 0.0 111.495 177.704 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 48.4 t60 -71.33 -41.34 69.96 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.301 0.64 . . . . 0.0 110.216 178.552 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 92.8 mt -75.08 0.2 16.89 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 123.193 0.597 . . . . 0.0 112.459 -179.006 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 86.3 mtp -80.09 -35.81 36.36 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.478 0.711 . . . . 0.0 109.317 166.917 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -106.28 -73.5 0.68 Allowed 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.136 0.975 . . . . 0.0 110.981 -173.912 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 -103.06 -168.6 1.54 Allowed 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 124.345 1.058 . . . . 0.0 110.703 -175.866 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.408 ' HG3' HG23 ' A' ' 51' ' ' THR . 59.6 pttt -150.55 22.33 0.81 Allowed 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.54 0.736 . . . . 0.0 109.845 176.312 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -97.84 165.39 11.96 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.796 0.838 . . . . 0.0 112.093 -174.062 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.67 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 48.9 t -91.73 39.24 1.0 Allowed 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 124.001 0.921 . . . . 0.0 111.889 -171.636 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 57.05 -84.98 0.02 OUTLIER 'General case' 0 CA--C 1.559 1.314 0 C-N-CA 125.3 1.44 . . . . 0.0 113.156 172.351 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 84.0 m-85 -78.17 -60.41 2.38 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.268 1.027 . . . . 0.0 111.474 -167.275 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 14.2 p -72.13 -21.15 61.51 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-N 117.7 0.227 . . . . 0.0 110.873 178.812 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 8.3 tmtt? 62.01 39.13 13.61 Favored 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 124.803 1.241 . . . . 0.0 111.019 175.284 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 25.2 m -88.63 137.09 32.64 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 166.899 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.408 HG23 ' HG3' ' A' ' 43' ' ' LYS . 29.1 m -68.17 120.66 14.72 Favored 'General case' 0 CA--C 1.554 1.1 0 CA-C-N 118.305 0.502 . . . . 0.0 110.406 -178.706 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 55.4 mt -67.44 131.25 33.05 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 C-N-CA 123.845 0.858 . . . . 0.0 110.115 -179.606 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 93.2 t -87.58 -40.58 13.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 122.855 0.462 . . . . 0.0 110.005 175.195 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.1 t -152.06 140.57 20.67 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 122.742 0.417 . . . . 0.0 110.754 -178.338 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 41.4 t -105.95 128.96 59.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 N-CA-C 108.739 -0.838 . . . . 0.0 108.739 175.819 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.5 mm-40 -118.33 157.31 27.33 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.64 1.176 . . . . 0.0 109.56 178.039 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -81.88 108.7 15.61 Favored 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 174.898 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 61.1 t90 . . . . . 0 N--CA 1.469 0.514 0 C-N-CA 122.89 0.476 . . . . 0.0 109.744 178.29 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.679 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 41.2 mt . . . . . 0 N--CA 1.472 0.631 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 11.8 t -58.66 108.08 1.19 Allowed Pre-proline 0 CA--C 1.549 0.935 0 CA-C-O 117.903 -1.046 . . . . 0.0 109.413 168.689 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -65.9 -13.16 38.53 Favored 'Trans proline' 0 C--N 1.381 2.265 0 C-N-CA 123.148 2.566 . . . . 0.0 113.237 -171.751 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 55.8 mt -67.71 -23.89 30.16 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.499 0 C-N-CA 124.03 0.932 . . . . 0.0 110.902 173.878 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 59.4 m -131.03 -55.09 1.05 Allowed 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 124.106 0.963 . . . . 0.0 111.235 -170.015 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 26.0 t80 75.69 28.3 0.93 Allowed 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 126.104 1.762 . . . . 0.0 109.907 178.925 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -104.28 -51.48 3.11 Favored 'General case' 0 CA--C 1.552 1.023 0 CA-C-N 115.469 -0.787 . . . . 0.0 112.246 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 12.2 m-70 -121.93 141.62 34.49 Favored Pre-proline 0 N--CA 1.495 1.806 0 C-N-CA 123.65 0.78 . . . . 0.0 109.948 -173.631 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.679 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 45.8 Cg_endo -84.15 47.26 2.19 Favored 'Trans proline' 0 C--N 1.386 2.539 0 C-N-CA 123.717 2.945 . . . . 0.0 114.796 -171.776 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.465 HG21 ' HB3' ' A' ' 29' ' ' LYS . 77.6 mt 68.21 143.63 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.352 0 C-N-CA 125.164 1.386 . . . . 0.0 112.649 172.273 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.0 t -155.11 19.9 0.43 Allowed 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 122.721 0.408 . . . . 0.0 111.144 176.091 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.474 ' HB2' ' HD2' ' A' ' 32' ' ' LYS . . . -139.97 132.23 28.24 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 122.879 0.472 . . . . 0.0 109.8 176.211 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.4 p -113.24 132.98 60.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 C-N-CA 123.486 0.714 . . . . 0.0 109.236 173.066 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 14.5 m-85 -87.84 90.49 8.4 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 -178.906 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -73.2 136.93 78.77 Favored Pre-proline 0 CA--C 1.553 1.089 0 CA-C-N 114.136 -1.393 . . . . 0.0 109.89 -178.215 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -98.15 20.34 26.46 Favored 'Cis proline' 0 C--N 1.374 1.911 0 N-CA-C 114.595 0.96 . . . . 0.0 114.595 -3.085 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 41.5 t -62.67 -65.6 0.66 Allowed 'General case' 0 N--CA 1.482 1.126 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -175.718 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 128.86 -25.68 4.63 Favored Glycine 0 C--N 1.35 1.347 0 CA-C-O 119.553 -0.582 . . . . 0.0 113.465 -178.001 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.647 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 26.4 m80 -63.06 147.78 49.72 Favored 'General case' 0 N--CA 1.484 1.259 0 CA-C-N 117.212 0.506 . . . . 0.0 109.64 171.077 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.465 ' HB3' HG21 ' A' ' 19' ' ' ILE . 96.1 mttt -133.95 168.92 17.9 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.926 0.89 . . . . 0.0 110.41 -173.567 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 21.2 t -168.81 177.57 4.99 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.604 0.762 . . . . 0.0 110.662 177.93 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 12.8 p -80.45 153.74 28.05 Favored 'General case' 0 C--O 1.246 0.876 0 CA-C-N 115.573 -0.739 . . . . 0.0 109.217 175.3 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.474 ' HD2' ' HB2' ' A' ' 21' ' ' ALA . 14.9 mmmm -57.96 -39.68 78.73 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.801 0.84 . . . . 0.0 112.366 -172.522 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -64.65 -35.95 82.69 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.783 0.833 . . . . 0.0 112.293 -176.246 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.8 m -59.0 -56.52 21.26 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.05 0.54 . . . . 0.0 111.238 177.895 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 8.4 tp -76.1 -31.32 21.42 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 CA-C-N 115.483 -0.78 . . . . 0.0 111.398 -172.115 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -63.73 -40.22 96.21 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-O 121.0 0.429 . . . . 0.0 110.465 177.138 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -76.12 -35.29 59.34 Favored 'General case' 0 CA--C 1.547 0.851 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.834 176.16 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 84.5 t60 -67.4 -42.97 82.43 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.371 0.668 . . . . 0.0 110.977 -175.277 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 67.9 mt -58.89 -23.88 61.56 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 124.234 1.013 . . . . 0.0 112.573 -177.245 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 55.0 mtt -66.98 -32.42 73.64 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 123.515 0.726 . . . . 0.0 110.756 176.698 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -100.73 -67.9 0.84 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 124.278 1.031 . . . . 0.0 110.559 179.234 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -124.49 156.66 36.88 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 124.019 0.928 . . . . 0.0 111.479 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 32.1 mtmm -102.45 17.47 23.5 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.247 0.619 . . . . 0.0 110.213 176.783 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 42.0 m-20 -88.18 151.74 22.48 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.499 0.72 . . . . 0.0 112.18 -169.151 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.647 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 39.2 t -88.64 58.7 4.78 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.658 0.783 . . . . 0.0 111.408 -177.069 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 42.97 -85.93 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 126.636 1.974 . . . . 0.0 115.094 171.347 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 53.1 m-85 -73.18 -38.23 66.24 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.384 1.074 . . . . 0.0 111.426 -165.979 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 16.2 p -102.63 -12.65 17.56 Favored 'General case' 0 N--CA 1.483 1.201 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.506 179.355 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.411 ' HE2' ' HB2' ' A' ' 49' ' ' LYS . 1.5 mppt? 54.26 17.74 1.6 Allowed 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 125.759 1.623 . . . . 0.0 113.691 -176.397 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 31.1 m -64.91 116.26 6.2 Favored 'General case' 0 C--N 1.35 0.594 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 174.999 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 13.1 m -60.13 116.15 3.99 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 122.879 0.472 . . . . 0.0 110.561 -173.86 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.454 HG21 HG22 ' A' ' 55' ' ' VAL . 37.6 mt -66.9 127.43 28.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 C-N-CA 124.733 1.213 . . . . 0.0 110.595 -171.537 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 29.0 t -80.89 -41.72 19.77 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.585 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 47.5 t -146.35 133.48 20.43 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.4 0.68 . . . . 0.0 109.483 177.398 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.454 HG22 HG21 ' A' ' 52' ' ' ILE . 45.9 t -98.54 104.14 15.59 Favored 'Isoleucine or valine' 0 C--O 1.245 0.853 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 172.95 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -91.29 143.66 26.41 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 122.785 0.434 . . . . 0.0 110.251 -178.107 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -76.77 108.44 9.79 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 173.111 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 37.6 t90 . . . . . 0 CA--C 1.541 0.618 0 C-N-CA 123.79 0.836 . . . . 0.0 110.696 -176.245 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.561 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 35.4 mt . . . . . 0 CA--C 1.542 0.644 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 40.6 t -58.68 115.79 12.99 Favored Pre-proline 0 CA--C 1.549 0.937 0 CA-C-O 117.844 -1.074 . . . . 0.0 108.65 171.366 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_exo -52.56 -30.09 43.39 Favored 'Trans proline' 0 N--CA 1.506 2.212 0 C-N-CA 123.12 2.546 . . . . 0.0 114.066 -171.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.404 HD12 ' H ' ' A' ' 13' ' ' ILE . 4.2 mp -77.04 -37.72 26.86 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.072 0 C-N-CA 124.109 0.964 . . . . 0.0 110.973 -177.339 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 73.9 m -106.07 -47.34 3.86 Favored 'General case' 0 N--CA 1.485 1.28 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 -167.553 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.414 ' HA ' ' HB3' ' A' ' 10' ' ' LEU . 53.4 m-85 77.78 -51.89 0.52 Allowed 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 126.637 1.975 . . . . 0.0 111.638 -174.898 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.13 -5.68 14.49 Favored 'General case' 0 N--CA 1.484 1.265 0 N-CA-C 114.374 1.25 . . . . 0.0 114.374 -170.35 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 28.1 m170 -135.58 132.88 19.91 Favored Pre-proline 0 N--CA 1.483 1.218 0 C-N-CA 123.412 0.685 . . . . 0.0 109.384 172.635 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.561 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 42.2 Cg_endo -86.2 71.31 4.18 Favored 'Trans proline' 0 C--N 1.377 2.054 0 C-N-CA 123.46 2.773 . . . . 0.0 114.386 -173.527 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 81.9 mt 61.88 170.42 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.499 2.024 0 C-N-CA 124.27 1.028 . . . . 0.0 111.017 176.392 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 70.3 m -156.31 -37.91 0.08 Allowed 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 124.074 0.95 . . . . 0.0 110.188 173.337 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.413 ' HA ' ' H ' ' A' ' 58' ' ' TRP . . . -127.28 171.51 11.41 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.093 0.957 . . . . 0.0 111.24 -174.309 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 4.8 p -141.56 140.11 31.39 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 C-N-CA 124.305 1.042 . . . . 0.0 109.443 -179.604 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -88.3 96.4 10.56 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 124.202 1.001 . . . . 0.0 108.878 -178.427 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.7 tp60 -92.75 145.92 31.22 Favored Pre-proline 0 CA--C 1.555 1.137 0 CA-C-N 114.802 -1.09 . . . . 0.0 109.658 -174.563 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -93.59 37.53 5.92 Favored 'Cis proline' 0 C--N 1.378 2.091 0 CA-C-N 120.035 1.048 . . . . 0.0 114.431 -2.384 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 19.3 t -75.66 -78.64 0.11 Allowed 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 122.539 0.336 . . . . 0.0 111.399 176.021 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 141.44 -26.5 2.42 Favored Glycine 0 C--N 1.357 1.702 0 CA-C-O 119.724 -0.487 . . . . 0.0 113.198 -173.615 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.433 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 48.0 m-70 -59.57 136.57 58.03 Favored 'General case' 0 N--CA 1.487 1.391 0 CA-C-N 117.144 0.472 . . . . 0.0 110.456 173.748 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -122.74 154.19 38.47 Favored 'General case' 0 C--O 1.238 0.447 0 C-N-CA 123.682 0.793 . . . . 0.0 110.445 -176.054 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 27.0 t -164.28 -168.91 1.66 Allowed 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.655 1.182 . . . . 0.0 107.842 -179.175 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 20.8 p -101.82 164.97 11.45 Favored 'General case' 0 N--CA 1.477 0.92 0 O-C-N 121.619 -0.676 . . . . 0.0 110.979 -179.465 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt -55.12 -42.84 73.47 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 124.576 1.151 . . . . 0.0 110.986 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.89 -44.84 94.01 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.743 0.817 . . . . 0.0 112.266 -177.282 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 7.0 m -58.57 -53.56 56.98 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 123.67 0.788 . . . . 0.0 112.195 -179.22 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 5.6 tp -70.75 -39.39 75.57 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.096 -174.22 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -61.95 -35.88 79.76 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.32 0.648 . . . . 0.0 110.858 177.488 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -73.67 -40.41 63.71 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 124.054 0.942 . . . . 0.0 110.935 176.343 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 77.2 t60 -66.61 -38.77 87.65 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.3 1.04 . . . . 0.0 111.799 -176.365 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 78.5 mt -62.79 -17.14 60.66 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.83 0.852 . . . . 0.0 112.91 -175.798 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 83.0 mtp -67.4 -31.25 71.33 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.432 0.693 . . . . 0.0 111.35 174.616 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 43.2 t-20 -104.38 -68.58 0.84 Allowed 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.7 m-80 -120.89 169.54 10.35 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 123.359 0.664 . . . . 0.0 111.119 -175.296 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 58.6 mmtt -111.25 10.75 21.74 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.396 0.678 . . . . 0.0 109.887 179.152 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 61.3 m-20 -85.5 163.88 18.16 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.726 0.811 . . . . 0.0 113.179 -168.766 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.433 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 42.0 t -92.75 61.14 3.55 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.467 0.707 . . . . 0.0 111.559 -176.698 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 47.37 -81.48 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 125.869 1.668 . . . . 0.0 114.298 164.828 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 47.7 m-85 -79.05 -46.61 17.77 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.368 1.067 . . . . 0.0 111.057 -170.708 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 15.5 p -100.18 -7.02 25.25 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 122.596 0.358 . . . . 0.0 111.498 -177.123 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 58.73 21.82 9.32 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 124.845 1.258 . . . . 0.0 113.623 176.149 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 29.5 m -72.91 124.77 26.1 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 174.35 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 28.5 m -60.23 115.8 3.77 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-O 120.907 0.384 . . . . 0.0 110.038 -178.458 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.463 HG21 HG22 ' A' ' 55' ' ' VAL . 38.7 mt -71.51 125.62 30.34 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 124.126 0.97 . . . . 0.0 110.624 -171.554 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 36.7 t -85.88 -41.47 15.32 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.774 0 C-N-CA 123.227 0.611 . . . . 0.0 109.678 -178.849 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 48.0 m -147.97 145.44 28.55 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.501 0.721 . . . . 0.0 110.024 178.194 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.463 HG22 HG21 ' A' ' 52' ' ' ILE . 38.3 t -115.11 104.62 17.15 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 175.4 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -88.64 144.48 26.26 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 110.065 -0.346 . . . . 0.0 110.065 179.901 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -73.8 103.74 4.45 Favored 'General case' 0 C--O 1.238 0.463 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 172.833 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' TRP . . . . . 0.413 ' H ' ' HA ' ' A' ' 21' ' ' ALA . 53.5 t90 . . . . . 0 CA--C 1.541 0.616 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 178.512 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.535 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 48.2 mt . . . . . 0 CA--C 1.538 0.496 0 CA-C-O 119.949 -0.072 . . . . 0.0 111.159 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 46.4 t -53.07 109.29 1.39 Allowed Pre-proline 0 C--N 1.352 0.685 0 O-C-N 124.375 1.047 . . . . 0.0 109.51 172.701 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -56.39 -31.05 83.94 Favored 'Trans proline' 0 C--N 1.373 1.832 0 C-N-CA 122.905 2.403 . . . . 0.0 113.376 -172.689 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 55.6 mt -66.56 -39.01 82.86 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.004 0 C-N-CA 124.262 1.025 . . . . 0.0 111.5 -179.383 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 82.5 m -106.87 -24.87 11.91 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.415 0.686 . . . . 0.0 112.68 -170.767 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 90.8 m-85 67.27 -60.44 0.37 Allowed 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 126.098 1.759 . . . . 0.0 112.86 -170.86 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.34 -44.13 92.69 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 114.791 1.404 . . . . 0.0 114.791 -165.241 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 54.4 m170 -104.37 150.84 38.88 Favored Pre-proline 0 N--CA 1.485 1.295 0 C-N-CA 123.179 0.591 . . . . 0.0 109.68 -175.571 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.535 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 84.0 Cg_endo -75.39 -164.42 0.24 Allowed 'Trans proline' 0 C--N 1.373 1.864 0 C-N-CA 123.049 2.5 . . . . 0.0 113.685 -179.063 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 97.4 mt -78.91 131.59 34.05 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.638 173.776 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 38.7 t -128.13 -5.84 5.5 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.188 0.995 . . . . 0.0 110.497 179.156 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -150.68 158.24 43.92 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.273 0.629 . . . . 0.0 111.309 -176.115 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.1 p -137.64 122.91 24.85 Favored 'Isoleucine or valine' 0 C--O 1.245 0.828 0 C-N-CA 124.293 1.037 . . . . 0.0 109.016 178.122 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.0 m-30 -75.23 86.09 2.44 Favored 'General case' 0 C--O 1.241 0.606 0 CA-C-N 115.167 -0.924 . . . . 0.0 108.674 178.682 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 11.4 mt-30 -87.83 146.47 38.96 Favored Pre-proline 0 CA--C 1.543 0.711 0 C-N-CA 122.87 0.468 . . . . 0.0 111.203 -174.513 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_endo -92.17 17.99 40.68 Favored 'Cis proline' 0 C--N 1.371 1.734 0 C-N-CA 124.859 -0.892 . . . . 0.0 114.094 3.151 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 27.4 t -72.29 -27.5 62.5 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 111.879 0.326 . . . . 0.0 111.879 -173.813 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 90.74 -16.85 57.21 Favored Glycine 0 C--N 1.347 1.179 0 CA-C-O 119.357 -0.69 . . . . 0.0 114.458 175.246 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 5.9 m80 -61.94 120.06 10.05 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.15 0.58 . . . . 0.0 110.26 175.973 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 52.5 mttp -110.13 159.47 17.32 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.563 0.697 . . . . 0.0 111.763 -174.428 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 93.0 p -166.37 -164.57 0.68 Allowed 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 114.183 -1.371 . . . . 0.0 107.894 173.266 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 16.3 p -86.24 154.17 21.47 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 171.015 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -67.55 -28.81 68.11 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.214 0.606 . . . . 0.0 110.239 -175.38 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -56.95 -41.54 78.45 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.766 0.826 . . . . 0.0 112.012 175.897 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.8 m -55.23 -59.26 5.03 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.511 0.724 . . . . 0.0 110.994 177.419 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.712 HG21 HG11 ' A' ' 55' ' ' VAL . 10.4 tp -73.79 -22.55 18.67 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.763 0 CA-C-N 115.3 -0.863 . . . . 0.0 111.599 -173.263 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -64.49 -42.26 95.97 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 122.802 0.441 . . . . 0.0 109.853 178.121 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 22.7 tm0? -74.69 -34.71 62.71 Favored 'General case' 0 CA--C 1.552 1.048 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.41 176.694 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.502 ' HB3' HD12 ' A' ' 35' ' ' ILE . 41.5 t60 -67.21 -39.93 86.36 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.829 0.852 . . . . 0.0 111.333 -177.69 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 72.7 mt -73.99 -0.89 17.66 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 123.7 0.8 . . . . 0.0 112.82 -177.333 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 64.1 mtt -72.85 -14.31 61.47 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 123.074 0.55 . . . . 0.0 111.245 174.007 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -149.41 -57.58 0.2 Allowed 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.633 0.773 . . . . 0.0 109.621 174.502 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 36.4 m-20 -79.68 172.59 13.58 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.914 0.886 . . . . 0.0 110.71 -175.086 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -159.69 54.18 0.37 Allowed 'General case' 0 N--CA 1.484 1.227 0 CA-C-O 122.073 0.94 . . . . 0.0 109.204 -176.379 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -155.14 174.27 15.43 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.21 -172.031 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 96.9 m -70.6 137.17 49.76 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.87 172.36 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 71.0 m-85 -58.43 -36.12 73.15 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-O 121.198 0.523 . . . . 0.0 109.854 167.964 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -76.91 -75.23 0.21 Allowed 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 124.625 1.17 . . . . 0.0 111.705 -172.585 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 7.2 p -91.98 -8.25 46.66 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.136 0.575 . . . . 0.0 112.368 -170.141 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 66.56 18.3 10.76 Favored 'General case' 0 CA--C 1.572 1.803 0 C-N-CA 124.287 1.035 . . . . 0.0 111.786 178.578 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 93.6 m -78.59 129.96 35.38 Favored 'General case' 0 N--CA 1.485 1.304 0 O-C-N 121.479 -0.763 . . . . 0.0 110.593 174.742 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 31.2 m -59.97 134.44 57.04 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.249 1.02 . . . . 0.0 111.123 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.505 HG21 HG22 ' A' ' 55' ' ' VAL . 22.0 mt -93.24 135.49 27.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 123.355 0.662 . . . . 0.0 109.94 -177.622 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 77.2 t -79.66 -46.37 22.75 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 C-N-CA 123.106 0.562 . . . . 0.0 109.549 174.223 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 47.1 p -160.33 134.71 7.42 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.035 0.534 . . . . 0.0 110.057 179.612 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.712 HG11 HG21 ' A' ' 35' ' ' ILE . 36.9 t -98.21 105.16 16.88 Favored 'Isoleucine or valine' 0 C--O 1.243 0.762 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 177.807 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -86.06 143.09 28.27 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 176.878 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -71.3 123.94 23.4 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 172.39 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 32.4 t90 . . . . . 0 C--O 1.242 0.698 0 CA-C-O 121.081 0.467 . . . . 0.0 111.102 -171.753 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.469 HD13 ' O ' ' A' ' 15' ' ' TYR . 75.2 mt . . . . . 0 N--CA 1.473 0.713 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 52.4 t -55.04 120.75 31.54 Favored Pre-proline 0 CA--C 1.555 1.155 0 CA-C-O 118.71 -0.662 . . . . 0.0 111.241 -177.263 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -58.1 -27.76 81.09 Favored 'Trans proline' 0 C--N 1.387 2.569 0 C-N-CA 123.236 2.624 . . . . 0.0 113.248 -172.785 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.5 mp -77.49 -47.15 26.76 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.939 0 CA-C-N 114.642 -1.163 . . . . 0.0 110.331 179.09 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 74.3 m -95.61 -59.15 1.93 Allowed 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.354 0.661 . . . . 0.0 111.85 -166.209 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.469 ' O ' HD13 ' A' ' 10' ' ' LEU . 22.6 m-85 75.19 -39.37 0.4 Allowed 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 125.72 1.608 . . . . 0.0 113.09 -172.865 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.57 -8.43 53.98 Favored 'General case' 0 N--CA 1.486 1.341 0 CA-C-N 118.812 0.733 . . . . 0.0 112.339 -179.213 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 70.0 m80 -142.09 153.54 63.69 Favored Pre-proline 0 CA--C 1.555 1.161 0 C-N-CA 124.003 0.921 . . . . 0.0 108.639 175.583 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -79.09 -159.63 0.11 Allowed 'Trans proline' 0 C--N 1.382 2.335 0 C-N-CA 123.289 2.659 . . . . 0.0 113.421 -177.112 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.441 HG21 ' HB3' ' A' ' 29' ' ' LYS . 53.7 mt -98.87 133.52 41.15 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 C-N-CA 124.188 0.995 . . . . 0.0 110.095 176.415 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.406 ' H ' ' HA ' ' A' ' 31' ' ' CYS . 50.1 m -137.4 18.0 2.93 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.196 0.998 . . . . 0.0 110.593 -179.491 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.421 ' HA ' ' O ' ' A' ' 56' ' ' GLU . . . -154.09 141.03 19.25 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.182 0.593 . . . . 0.0 110.747 -176.359 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 6.9 p -123.51 133.21 69.81 Favored 'Isoleucine or valine' 0 C--O 1.241 0.607 0 C-N-CA 123.522 0.729 . . . . 0.0 109.208 173.626 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -86.96 91.24 8.62 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-N 115.182 -0.917 . . . . 0.0 108.606 -179.728 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -83.07 141.99 43.93 Favored Pre-proline 0 CA--C 1.552 1.023 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.389 -171.36 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_endo -97.49 23.62 23.46 Favored 'Cis proline' 0 C--N 1.377 2.031 0 CA-C-N 119.369 0.81 . . . . 0.0 113.2 -1.944 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 43.0 t -63.34 -55.4 24.86 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.313 0.645 . . . . 0.0 111.757 -176.101 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 117.09 -25.31 8.87 Favored Glycine 0 C--N 1.345 1.074 0 CA-C-O 119.351 -0.694 . . . . 0.0 113.681 -179.356 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.436 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 19.9 m170 -58.64 141.53 52.16 Favored 'General case' 0 N--CA 1.484 1.256 0 CA-C-N 117.43 0.615 . . . . 0.0 109.566 172.087 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.441 ' HB3' HG21 ' A' ' 19' ' ' ILE . 53.9 mttp -132.63 165.09 25.23 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.004 0.522 . . . . 0.0 110.747 -174.389 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 42.9 t -172.18 -179.87 2.43 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.258 1.423 . . . . 0.0 107.909 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.406 ' HA ' ' H ' ' A' ' 20' ' ' SER . 13.9 p -78.24 150.13 33.5 Favored 'General case' 0 C--O 1.245 0.848 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 171.912 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -60.6 -38.12 83.63 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 122.922 0.489 . . . . 0.0 111.827 -175.66 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.41 -32.05 69.82 Favored 'General case' 0 CA--C 1.554 1.133 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -176.563 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.1 m -61.33 -58.43 8.28 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 123.454 0.702 . . . . 0.0 111.139 172.961 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.552 HG21 HG11 ' A' ' 55' ' ' VAL . 7.0 tp -69.37 -30.4 45.62 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 O-C-N 123.285 0.366 . . . . 0.0 111.295 -173.009 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 61.0 t30 -63.38 -45.7 89.9 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 175.831 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -65.79 -33.57 76.16 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.853 0.861 . . . . 0.0 110.509 175.018 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 69.9 t60 -71.42 -32.78 68.78 Favored 'General case' 0 C--O 1.217 -0.644 0 C-N-CA 123.584 0.753 . . . . 0.0 110.372 -179.342 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.519 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 90.9 mt -66.61 -9.57 36.84 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 123.629 0.772 . . . . 0.0 111.913 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 82.2 mtp -76.69 -41.74 44.24 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 122.979 0.512 . . . . 0.0 109.732 168.725 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -76.09 -70.41 0.44 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.039 0.935 . . . . 0.0 110.294 179.412 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 -143.87 167.39 22.44 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 125.121 1.368 . . . . 0.0 109.271 -177.242 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -98.33 21.2 11.35 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-O 121.813 0.816 . . . . 0.0 110.31 175.364 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -90.37 166.26 13.39 Favored 'General case' 0 CA--C 1.545 0.75 0 CA-C-O 121.811 0.815 . . . . 0.0 112.778 -173.066 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.436 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 43.6 t -96.02 54.35 1.46 Allowed 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 115.287 -0.87 . . . . 0.0 111.245 -171.662 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 49.68 -84.61 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 125.777 1.631 . . . . 0.0 113.649 174.602 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 40.3 m-85 -74.73 -65.4 0.87 Allowed 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.605 1.162 . . . . 0.0 109.937 -169.266 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 14.0 p -75.07 -17.08 60.53 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 122.535 0.334 . . . . 0.0 111.215 -177.847 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 52.1 mttp 65.34 23.56 12.07 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 125.299 1.44 . . . . 0.0 113.372 176.329 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 36.2 m -69.09 128.31 36.2 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 122.563 0.345 . . . . 0.0 110.173 174.337 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 18.0 m -62.27 110.68 1.71 Allowed 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 176.303 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 42.0 mt -70.98 135.14 28.68 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 124.131 0.972 . . . . 0.0 110.977 -172.604 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 60.1 t -78.19 -51.76 17.08 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 C-N-CA 122.97 0.508 . . . . 0.0 109.701 177.84 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 50.3 m -149.91 151.51 33.53 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 -179.127 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.552 HG11 HG21 ' A' ' 35' ' ' ILE . 47.6 t -121.23 110.21 27.31 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.11 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 177.674 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.421 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 1.6 mp0 -92.91 154.59 18.11 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 122.909 0.484 . . . . 0.0 110.785 179.517 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -67.63 96.6 0.55 Allowed 'General case' 0 C--O 1.241 0.631 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 168.809 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 52.9 t90 . . . . . 0 C--O 1.238 0.454 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 176.581 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.665 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 79.4 mt . . . . . 0 CA--C 1.54 0.574 0 N-CA-C 111.497 0.184 . . . . 0.0 111.497 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 46.0 t -59.82 119.15 38.4 Favored Pre-proline 0 CA--C 1.545 0.781 0 CA-C-O 118.208 -0.901 . . . . 0.0 108.773 172.122 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -59.81 -28.17 86.61 Favored 'Trans proline' 0 C--N 1.374 1.92 0 C-N-CA 122.586 2.191 . . . . 0.0 112.39 -175.618 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 69.6 mt -72.05 -32.61 44.36 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.099 0 C-N-CA 124.758 1.223 . . . . 0.0 112.201 -179.675 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 79.0 m -118.37 -50.61 2.44 Favored 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -167.091 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 80.39 -42.42 0.22 Allowed 'General case' 0 N--CA 1.498 1.946 0 C-N-CA 126.594 1.958 . . . . 0.0 112.445 -179.109 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.95 -33.32 71.76 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.444 0.698 . . . . 0.0 112.606 -176.343 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 11.6 m170 -125.14 155.33 71.2 Favored Pre-proline 0 N--CA 1.485 1.289 0 C-N-CA 124.099 0.96 . . . . 0.0 109.196 -179.641 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.665 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 95.0 Cg_endo -75.64 -163.51 0.2 Allowed 'Trans proline' 0 C--N 1.38 2.224 0 C-N-CA 122.914 2.41 . . . . 0.0 113.401 -176.332 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 86.8 mt -89.11 142.72 12.48 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 C-N-CA 123.833 0.853 . . . . 0.0 108.869 171.275 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.436 ' HB3' ' H ' ' A' ' 32' ' ' LYS . 39.7 t -129.2 -16.73 3.95 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.479 0.712 . . . . 0.0 110.785 178.687 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -145.58 133.02 20.72 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -168.853 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.6 p -102.5 143.07 15.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 124.892 1.277 . . . . 0.0 109.542 169.409 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 18.5 m-85 -99.13 85.62 3.27 Favored 'General case' 0 C--O 1.242 0.674 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 176.532 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 63.1 tt0 -82.77 143.44 46.73 Favored Pre-proline 0 CA--C 1.553 1.088 0 CA-C-N 114.157 -1.383 . . . . 0.0 108.944 -174.096 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -92.41 13.64 50.37 Favored 'Cis proline' 0 C--N 1.386 2.524 0 N-CA-C 115.925 1.471 . . . . 0.0 115.925 1.846 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 50.8 t -62.03 -53.78 50.8 Favored 'General case' 0 N--CA 1.484 1.251 0 CA-C-N 118.55 0.614 . . . . 0.0 111.798 -177.546 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 129.43 -43.05 1.35 Allowed Glycine 0 C--N 1.347 1.176 0 CA-C-O 119.15 -0.806 . . . . 0.0 113.297 177.422 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.654 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 34.5 m80 -52.16 136.01 30.79 Favored 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 123.426 0.69 . . . . 0.0 112.572 -177.361 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 6.2 mptt -118.49 168.88 10.26 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.514 0.726 . . . . 0.0 110.997 178.225 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 96.9 p -170.2 -176.07 2.14 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.068 1.347 . . . . 0.0 107.738 171.057 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 17.8 p -72.63 146.69 46.43 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 168.683 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.436 ' H ' ' HB3' ' A' ' 20' ' ' SER . 35.2 ttpt -70.31 -16.87 63.05 Favored 'General case' 0 N--CA 1.483 1.213 0 CA-C-O 121.079 0.466 . . . . 0.0 110.882 -175.221 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.91 -39.94 91.23 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 123.646 0.779 . . . . 0.0 111.299 170.171 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.5 m -56.42 -52.42 64.72 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.761 0.824 . . . . 0.0 111.297 178.088 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.437 HD11 HG13 ' A' ' 52' ' ' ILE . 9.7 tp -71.36 -32.78 47.89 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 O-C-N 123.398 0.436 . . . . 0.0 111.04 -174.753 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -59.13 -47.96 83.36 Favored 'General case' 0 N--CA 1.484 1.242 0 CA-C-O 121.104 0.478 . . . . 0.0 110.237 173.833 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -73.3 -21.61 60.54 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 115.035 -0.984 . . . . 0.0 111.699 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 46.7 t60 -77.66 -37.43 49.87 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.557 0.743 . . . . 0.0 110.163 177.979 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 96.1 mt -73.77 0.73 12.19 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 124.025 0.93 . . . . 0.0 111.648 179.619 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 23.5 mmt -78.8 -14.94 58.98 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 124.134 0.973 . . . . 0.0 110.408 169.766 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -134.83 -70.42 0.5 Allowed 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 123.855 0.862 . . . . 0.0 109.854 179.185 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -102.25 -174.83 2.67 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 124.064 0.946 . . . . 0.0 111.873 -174.058 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -144.93 64.82 1.28 Allowed 'General case' 0 C--N 1.349 0.587 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 175.501 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.472 ' HB3' ' HA ' ' A' ' 49' ' ' LYS . 18.5 m-20 -137.65 159.93 40.6 Favored 'General case' 0 N--CA 1.483 1.202 0 CA-C-O 121.736 0.779 . . . . 0.0 111.295 -169.436 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.654 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 21.8 t -94.51 37.0 1.13 Allowed 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 124.891 1.276 . . . . 0.0 111.194 -172.951 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 58.65 -86.32 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 125.04 1.336 . . . . 0.0 113.65 169.603 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 -87.66 44.71 1.21 Allowed 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 124.871 1.268 . . . . 0.0 112.664 -167.044 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 23.5 p 175.8 -31.96 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 126.093 1.757 . . . . 0.0 107.885 -178.936 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.472 ' HA ' ' HB3' ' A' ' 44' ' ' ASP . 9.9 mtmp? 63.1 38.65 10.61 Favored 'General case' 0 C--N 1.365 1.258 0 C-N-CA 125.301 1.441 . . . . 0.0 111.999 -178.017 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 8.0 m -71.97 129.21 38.0 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 166.664 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 47.9 m -57.09 131.99 51.57 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 123.093 0.557 . . . . 0.0 110.551 178.629 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.437 HG13 HD11 ' A' ' 35' ' ' ILE . 38.0 mm -63.09 113.43 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 123.083 0.553 . . . . 0.0 111.051 -175.118 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 75.1 t -77.13 -56.76 7.14 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 170.67 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 62.6 m -153.21 136.17 15.48 Favored 'General case' 0 C--O 1.246 0.903 0 C-N-CA 123.312 0.645 . . . . 0.0 111.073 177.863 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 59.9 t -95.26 105.01 16.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 123.973 0.909 . . . . 0.0 108.667 170.724 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 23.6 mm-40 -97.26 146.75 24.82 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 172.649 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -75.29 112.17 11.31 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 172.435 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 57.7 t90 . . . . . 0 CA--C 1.544 0.741 0 C-N-CA 123.415 0.686 . . . . 0.0 111.218 -174.136 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.656 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 85.1 mt . . . . . 0 N--CA 1.471 0.598 0 CA-C-O 120.573 0.225 . . . . 0.0 111.197 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 41.2 t -60.32 118.66 35.65 Favored Pre-proline 0 CA--C 1.545 0.77 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.486 173.85 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -65.92 -15.16 47.8 Favored 'Trans proline' 0 N--CA 1.5 1.877 0 C-N-CA 122.549 2.166 . . . . 0.0 113.013 -174.352 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 43.8 mt -85.96 -20.06 8.15 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.205 0 C-N-CA 124.478 1.111 . . . . 0.0 111.034 -178.462 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 39.8 m -134.39 -51.62 0.81 Allowed 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -169.679 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 78.95 -40.08 0.24 Allowed 'General case' 0 N--CA 1.498 1.954 0 C-N-CA 126.194 1.798 . . . . 0.0 112.981 -178.345 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.18 -14.66 56.73 Favored 'General case' 0 CA--C 1.559 1.3 0 N-CA-C 113.121 0.786 . . . . 0.0 113.121 -177.083 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 57.7 m-70 -137.77 150.36 67.6 Favored Pre-proline 0 N--CA 1.485 1.288 0 C-N-CA 124.049 0.94 . . . . 0.0 109.458 172.123 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.656 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 87.6 Cg_endo -76.02 -165.7 0.32 Allowed 'Trans proline' 0 C--N 1.382 2.341 0 C-N-CA 123.144 2.563 . . . . 0.0 113.762 178.107 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 65.9 mt -78.29 149.28 5.83 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.93 0 C-N-CA 123.448 0.699 . . . . 0.0 110.445 175.656 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.6 m -136.13 -32.65 0.86 Allowed 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.628 0.771 . . . . 0.0 111.079 -179.213 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -130.21 152.9 49.14 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.547 0.739 . . . . 0.0 111.584 -170.26 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.47 HG13 HE22 ' A' ' 24' ' ' GLN . 7.2 p -128.53 138.69 53.94 Favored 'Isoleucine or valine' 0 C--O 1.244 0.771 0 C-N-CA 124.828 1.251 . . . . 0.0 108.29 176.066 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 19.0 m-85 -107.27 105.62 15.68 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.094 0.558 . . . . 0.0 110.782 -169.305 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.47 HE22 HG13 ' A' ' 22' ' ' VAL . 2.9 mp0 -82.6 149.37 60.57 Favored Pre-proline 0 N--CA 1.474 0.735 0 C-N-CA 123.976 0.91 . . . . 0.0 110.469 174.804 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -97.15 81.64 0.13 OUTLIER 'Cis proline' 0 C--N 1.369 1.619 0 CA-C-N 118.853 0.626 . . . . 0.0 110.871 -3.304 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 36.6 t -143.11 -64.52 0.4 Allowed 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.861 -0.609 . . . . 0.0 112.127 -175.92 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 114.96 -12.03 20.28 Favored Glycine 0 C--N 1.345 1.032 0 CA-C-O 118.884 -0.953 . . . . 0.0 113.79 -176.576 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.424 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 6.1 m170 -58.31 139.42 55.25 Favored 'General case' 0 N--CA 1.491 1.606 0 CA-C-N 118.17 0.985 . . . . 0.0 110.207 171.541 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 57.4 mttp -130.41 156.28 45.0 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.318 0.647 . . . . 0.0 110.729 -174.136 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 92.9 p -169.0 -179.39 3.62 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.27 1.028 . . . . 0.0 109.11 174.028 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 13.6 p -69.04 148.91 49.37 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 173.331 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -71.03 -18.16 62.59 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-N 117.859 0.3 . . . . 0.0 111.667 -174.53 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.17 -34.38 74.95 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 122.369 0.268 . . . . 0.0 111.47 171.901 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.7 m -60.86 -51.72 68.11 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.496 0.718 . . . . 0.0 111.243 177.223 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.426 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 10.0 tp -71.33 -31.81 44.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 O-C-N 123.236 0.335 . . . . 0.0 110.849 -176.67 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 4.7 t30 -60.93 -46.49 90.46 Favored 'General case' 0 N--CA 1.48 1.05 0 CA-C-O 121.288 0.566 . . . . 0.0 109.967 174.767 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 63.7 tt0 -72.09 -27.12 62.45 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.083 178.537 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 47.3 t60 -77.17 -39.24 49.7 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 122.802 0.441 . . . . 0.0 110.674 -177.777 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 69.6 mt -66.33 -25.44 66.82 Favored 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 112.828 0.677 . . . . 0.0 112.828 -173.276 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 26.6 ptm -75.19 -14.15 60.52 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 122.541 0.336 . . . . 0.0 111.482 175.852 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 46.1 m-80 -105.87 -67.22 0.94 Allowed 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.203 0.601 . . . . 0.0 110.401 175.92 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 41.5 m-80 -132.17 -168.37 2.03 Favored 'General case' 0 N--CA 1.49 1.537 0 C-N-CA 124.871 1.268 . . . . 0.0 110.75 -176.054 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 82.4 tttt -135.62 9.41 3.38 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 123.389 0.675 . . . . 0.0 110.776 176.55 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.413 ' HB2' ' HA ' ' A' ' 49' ' ' LYS . 3.7 p30 -74.64 167.61 21.44 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-O 121.336 0.588 . . . . 0.0 111.372 -179.444 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.424 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 53.5 t -90.24 52.75 2.31 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.561 0.744 . . . . 0.0 110.877 -177.875 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 35.6 m-85 54.97 -80.25 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 126.084 1.754 . . . . 0.0 113.262 172.644 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 48.8 m-85 -83.58 -62.69 1.51 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.334 1.054 . . . . 0.0 110.732 -172.214 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 9.4 p -80.34 -7.95 59.29 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 122.829 0.451 . . . . 0.0 111.959 -173.803 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.413 ' HA ' ' HB2' ' A' ' 44' ' ' ASP . 74.4 mmtt 67.99 11.52 8.4 Favored 'General case' 0 N--CA 1.484 1.27 0 N-CA-C 114.583 1.327 . . . . 0.0 114.583 172.686 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 39.3 m -64.12 136.35 57.18 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 122.886 0.474 . . . . 0.0 111.025 176.826 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 90.0 m -63.06 119.91 10.42 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 122.861 0.464 . . . . 0.0 110.305 176.58 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.416 HD11 ' HA ' ' A' ' 45' ' ' CYS . 53.3 mt -79.13 104.29 6.96 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.797 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 -178.531 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 88.0 t -75.05 -31.38 24.85 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.818 0 C-N-CA 123.722 0.809 . . . . 0.0 110.735 177.668 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.3 t -151.7 134.18 15.39 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-O 120.678 0.275 . . . . 0.0 111.036 179.516 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 59.3 t -105.11 103.42 15.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 171.718 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -109.28 146.04 34.94 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.094 0.558 . . . . 0.0 110.556 -175.317 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -72.09 106.69 4.43 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.239 0.616 . . . . 0.0 110.347 -177.61 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 60.3 t90 . . . . . 0 C--O 1.239 0.548 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 176.827 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.606 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 63.1 mt . . . . . 0 CA--C 1.544 0.712 0 N-CA-C 110.755 -0.091 . . . . 0.0 110.755 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.576 ' SG ' ' HB2' ' A' ' 30' ' ' SER . 43.0 t -47.38 112.0 1.87 Allowed Pre-proline 0 N--CA 1.476 0.857 0 C-N-CA 125.291 1.436 . . . . 0.0 110.617 -177.009 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -60.25 -16.66 41.98 Favored 'Trans proline' 0 N--CA 1.506 2.264 0 C-N-CA 123.041 2.494 . . . . 0.0 114.085 -169.137 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 68.4 mt -81.26 -43.13 20.27 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.108 0 C-N-CA 124.052 0.941 . . . . 0.0 110.787 177.16 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 93.1 m -97.69 -41.87 7.9 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 123.864 0.866 . . . . 0.0 112.498 -168.899 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 75.48 -46.45 0.57 Allowed 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 126.756 2.022 . . . . 0.0 112.333 -176.113 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.05 -37.38 87.38 Favored 'General case' 0 N--CA 1.484 1.256 0 N-CA-C 113.75 1.018 . . . . 0.0 113.75 -173.376 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 44.5 m170 -121.44 152.82 58.52 Favored Pre-proline 0 N--CA 1.484 1.26 0 C-N-CA 123.479 0.711 . . . . 0.0 109.521 -177.734 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.606 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 49.4 Cg_endo -82.4 -170.28 0.91 Allowed 'Trans proline' 0 C--N 1.379 2.151 0 C-N-CA 123.138 2.559 . . . . 0.0 114.243 -175.273 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.413 HG21 ' HB3' ' A' ' 29' ' ' LYS . 88.8 mt -81.38 140.24 16.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 123.674 0.79 . . . . 0.0 109.965 178.693 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.0 m -140.64 3.85 1.9 Allowed 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.224 0.61 . . . . 0.0 111.276 -177.104 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -152.92 157.27 40.39 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.116 0.566 . . . . 0.0 112.199 -171.131 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.9 p -135.06 140.27 45.57 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 C-N-CA 124.301 1.041 . . . . 0.0 109.185 174.249 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -99.94 99.45 10.22 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.79 0.836 . . . . 0.0 110.704 -173.459 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -72.59 146.94 89.15 Favored Pre-proline 0 N--CA 1.481 1.109 0 C-N-CA 123.845 0.858 . . . . 0.0 111.559 173.303 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 15.8 Cg_endo -95.24 28.41 17.22 Favored 'Cis proline' 0 C--N 1.377 2.027 0 C-N-CA 125.561 -0.6 . . . . 0.0 112.022 -3.621 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 36.9 t -81.36 -74.81 0.31 Allowed 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.447 0.699 . . . . 0.0 111.611 -176.041 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 136.2 -21.93 3.44 Favored Glycine 0 C--N 1.351 1.381 0 CA-C-O 119.362 -0.688 . . . . 0.0 113.927 -177.31 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.411 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 13.4 m170 -58.93 142.83 49.79 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 123.077 0.551 . . . . 0.0 111.174 178.632 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.413 ' HB3' HG21 ' A' ' 19' ' ' ILE . 53.7 mttm -129.35 145.64 51.35 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.62 0.768 . . . . 0.0 110.817 -169.526 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.576 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 96.0 p -165.65 -177.3 4.29 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.51 1.124 . . . . 0.0 108.389 173.572 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 14.1 p -66.25 142.83 57.55 Favored 'General case' 0 N--CA 1.478 0.935 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 172.17 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -62.69 -29.88 70.98 Favored 'General case' 0 N--CA 1.487 1.381 0 CA-C-N 117.888 0.313 . . . . 0.0 111.57 -177.288 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -53.85 -30.52 45.82 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.419 1.088 . . . . 0.0 112.633 176.272 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.3 m -59.28 -56.87 16.56 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.702 0.801 . . . . 0.0 111.11 175.758 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.562 HG21 HG11 ' A' ' 55' ' ' VAL . 8.3 tp -76.53 -21.71 15.09 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.68 0 O-C-N 123.351 0.407 . . . . 0.0 110.918 -174.725 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -66.03 -41.78 90.46 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 173.305 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -69.97 -40.78 75.17 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.397 0.679 . . . . 0.0 110.623 173.891 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.462 ' HB3' HD12 ' A' ' 35' ' ' ILE . 78.5 t60 -70.79 -34.32 71.66 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.97 -172.691 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 54.3 mt -71.06 -10.94 60.61 Favored 'General case' 0 N--CA 1.494 1.749 0 CA-C-N 118.364 0.529 . . . . 0.0 112.277 179.79 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 52.8 mtt -77.18 -17.4 58.58 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.381 0.673 . . . . 0.0 110.227 170.568 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 30.1 t30 -112.28 -75.12 0.61 Allowed 'General case' 0 CA--C 1.558 1.284 0 C-N-CA 124.929 1.292 . . . . 0.0 110.388 179.338 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -127.27 173.65 9.58 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 124.246 1.018 . . . . 0.0 110.961 -176.785 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -112.04 18.59 18.61 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 122.905 0.482 . . . . 0.0 111.556 -176.65 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -96.16 165.71 12.1 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-O 121.4 0.619 . . . . 0.0 112.595 -169.454 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.411 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 53.2 t -94.62 46.05 1.13 Allowed 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.791 0.836 . . . . 0.0 111.69 -174.843 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 77.5 m-85 54.19 -82.9 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 125.908 1.683 . . . . 0.0 113.54 172.524 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -71.49 -63.12 1.18 Allowed 'General case' 0 C--N 1.348 0.51 0 C-N-CA 124.32 1.048 . . . . 0.0 110.436 -171.726 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 14.6 p -79.74 -14.54 58.65 Favored 'General case' 0 N--CA 1.484 1.233 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.282 -176.254 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 88.8 mttt 64.31 14.98 9.14 Favored 'General case' 0 N--CA 1.494 1.74 0 C-N-CA 124.996 1.318 . . . . 0.0 113.518 175.681 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 16.8 m -67.77 121.91 16.97 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 174.668 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 35.2 m -62.72 117.37 6.21 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-O 121.198 0.523 . . . . 0.0 110.187 -179.102 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 57.9 mt -72.46 129.88 35.63 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 C-N-CA 124.669 1.188 . . . . 0.0 111.132 -173.282 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 76.3 t -79.62 -55.39 9.33 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 172.866 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.9 m -137.54 144.91 42.34 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.396 0.678 . . . . 0.0 110.284 -173.954 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.562 HG11 HG21 ' A' ' 35' ' ' ILE . 56.1 t -117.05 119.07 60.85 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 N-CA-C 108.493 -0.928 . . . . 0.0 108.493 171.389 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -99.92 168.32 9.95 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 122.999 0.52 . . . . 0.0 110.525 174.362 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -93.69 101.03 13.15 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 174.223 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 29.8 t90 . . . . . 0 CA--C 1.545 0.768 0 CA-C-O 120.87 0.367 . . . . 0.0 110.955 -174.092 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 81.4 mt . . . . . 0 C--O 1.239 0.548 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.452 ' SG ' ' HB2' ' A' ' 30' ' ' SER . 51.9 t -56.52 112.57 4.63 Favored Pre-proline 0 N--CA 1.484 1.251 0 CA-C-O 118.74 -0.647 . . . . 0.0 110.079 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -61.08 -17.18 50.53 Favored 'Trans proline' 0 C--N 1.377 2.078 0 C-N-CA 123.307 2.671 . . . . 0.0 113.375 -172.257 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 68.9 mt -84.55 -48.45 16.71 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.064 0 C-N-CA 124.031 0.932 . . . . 0.0 110.906 176.629 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 90.1 m -86.41 -53.24 5.12 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.152 0.581 . . . . 0.0 111.801 -171.915 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 78.39 -40.32 0.28 Allowed 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 126.515 1.926 . . . . 0.0 112.329 -175.303 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -78.0 -10.71 59.73 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 113.093 0.775 . . . . 0.0 113.093 -176.961 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -139.96 154.31 70.4 Favored Pre-proline 0 N--CA 1.483 1.206 0 C-N-CA 123.851 0.86 . . . . 0.0 109.383 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_endo -77.15 -173.69 1.89 Allowed 'Trans proline' 0 C--N 1.38 2.192 0 C-N-CA 123.045 2.497 . . . . 0.0 114.232 -174.334 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.512 HG21 ' HB3' ' A' ' 29' ' ' LYS . 67.5 mt -89.27 143.33 11.39 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.807 0 CA-C-N 114.767 -1.106 . . . . 0.0 109.659 175.586 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 78.4 p -150.13 19.73 0.87 Allowed 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.134 0.573 . . . . 0.0 111.195 179.683 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -158.38 138.42 12.27 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.477 0.711 . . . . 0.0 110.704 -178.866 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 10.5 p -116.69 139.93 41.36 Favored 'Isoleucine or valine' 0 C--O 1.245 0.824 0 C-N-CA 124.096 0.958 . . . . 0.0 109.213 171.069 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 15.0 m-85 -97.46 86.7 3.93 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 176.733 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.523 ' HG3' ' HA ' ' A' ' 25' ' ' PRO . 8.5 tt0 -91.21 140.98 25.87 Favored Pre-proline 0 CA--C 1.553 1.084 0 N-CA-C 108.358 -0.978 . . . . 0.0 108.358 -173.893 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.523 ' HA ' ' HG3' ' A' ' 24' ' ' GLN . 12.0 Cg_endo -94.09 22.82 28.16 Favored 'Cis proline' 0 C--N 1.387 2.583 0 N-CA-C 116.246 1.595 . . . . 0.0 116.246 7.609 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 35.3 t -68.52 -63.91 0.97 Allowed 'General case' 0 N--CA 1.481 1.08 0 CA-C-N 118.315 0.507 . . . . 0.0 111.572 178.945 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 124.82 -25.5 5.84 Favored Glycine 0 C--N 1.35 1.312 0 CA-C-O 119.323 -0.71 . . . . 0.0 113.17 -177.222 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.415 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 22.9 m-70 -56.15 140.01 45.59 Favored 'General case' 0 N--CA 1.49 1.574 0 CA-C-N 117.25 0.525 . . . . 0.0 110.498 173.87 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.512 ' HB3' HG21 ' A' ' 19' ' ' ILE . 61.2 mttp -133.99 151.42 51.45 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.905 0.882 . . . . 0.0 110.634 -173.429 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.452 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 89.1 p -164.51 -173.86 3.22 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.82 1.248 . . . . 0.0 107.842 173.606 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.42 ' SG ' ' HB3' ' A' ' 33' ' ' ALA . 20.0 p -79.12 149.99 31.89 Favored 'General case' 0 C--O 1.244 0.766 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 173.94 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 63.2 pttt -65.6 -18.1 65.07 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.161 0.584 . . . . 0.0 112.169 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.42 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . . . -62.13 -40.75 96.98 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 123.318 0.647 . . . . 0.0 111.332 172.515 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.8 m -59.52 -52.8 64.01 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.618 0.767 . . . . 0.0 111.174 179.273 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.567 HG21 HG11 ' A' ' 55' ' ' VAL . 9.3 tp -73.18 -32.89 40.15 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.708 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.99 -174.41 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -61.47 -44.95 96.19 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-O 121.014 0.435 . . . . 0.0 109.986 177.567 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -60.15 -40.29 89.36 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 114.784 -1.098 . . . . 0.0 110.974 173.693 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 73.0 t60 -73.85 -33.15 63.99 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 114.759 -1.109 . . . . 0.0 111.698 -174.841 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 78.8 mt -71.79 -9.13 57.86 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 123.521 0.729 . . . . 0.0 112.102 -176.522 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 17.5 mmt -74.72 -24.6 58.76 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 123.18 0.592 . . . . 0.0 109.747 172.274 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 39.2 t30 -111.34 -73.13 0.69 Allowed 'General case' 0 CA--C 1.555 1.141 0 C-N-CA 124.532 1.133 . . . . 0.0 110.344 -178.8 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -120.71 -175.17 2.97 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 123.976 0.91 . . . . 0.0 111.15 -175.434 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt -136.63 20.25 3.1 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 123.831 0.852 . . . . 0.0 109.6 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -85.85 164.13 17.7 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 121.291 0.567 . . . . 0.0 110.868 -177.789 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.415 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 53.5 t -91.39 38.65 0.98 Allowed 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.067 0.947 . . . . 0.0 111.97 -173.165 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 57.43 -84.66 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 125.756 1.622 . . . . 0.0 112.627 171.416 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 -67.64 -50.43 58.02 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.593 1.157 . . . . 0.0 110.644 -169.222 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 14.7 p -97.63 -7.85 30.17 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.387 -177.824 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt 59.94 13.19 3.51 Favored 'General case' 0 CA--C 1.57 1.744 0 C-N-CA 125.506 1.522 . . . . 0.0 114.299 177.581 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 55.7 m -64.32 134.17 54.13 Favored 'General case' 0 N--CA 1.479 0.979 0 O-C-N 121.249 -0.907 . . . . 0.0 110.44 176.703 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 25.6 m -63.11 112.54 2.68 Favored 'General case' 0 C--O 1.245 0.868 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 177.75 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.503 HG21 HG22 ' A' ' 55' ' ' VAL . 30.5 mt -69.49 124.02 24.44 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 O-C-N 123.728 0.642 . . . . 0.0 109.825 -174.737 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 89.7 t -71.01 -51.31 36.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 O-C-N 123.705 0.628 . . . . 0.0 109.799 177.15 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 36.2 p -143.34 133.18 23.98 Favored 'General case' 0 C--O 1.249 1.026 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.703 178.595 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.567 HG11 HG21 ' A' ' 35' ' ' ILE . 23.3 t -102.04 106.97 20.69 Favored 'Isoleucine or valine' 0 C--N 1.348 0.528 0 N-CA-C 107.933 -1.136 . . . . 0.0 107.933 174.355 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -115.7 157.4 24.32 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.63 0.772 . . . . 0.0 110.215 -174.059 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -77.96 128.1 33.39 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 74.7 t90 . . . . . 0 C--O 1.236 0.361 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 175.526 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.621 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 90.2 mt . . . . . 0 N--CA 1.474 0.762 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 50.5 t -57.95 115.05 9.85 Favored Pre-proline 0 CA--C 1.548 0.901 0 O-C-N 123.874 0.734 . . . . 0.0 109.794 178.455 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_endo -57.45 -18.11 30.22 Favored 'Trans proline' 0 N--CA 1.508 2.335 0 C-N-CA 123.505 2.803 . . . . 0.0 114.034 -172.704 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 56.7 mt -90.29 -42.62 14.22 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.068 0 C-N-CA 123.954 0.902 . . . . 0.0 111.629 178.675 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 77.7 m -95.24 -53.37 3.81 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 123.114 0.566 . . . . 0.0 110.852 -171.645 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 20.4 t80 80.02 -41.57 0.22 Allowed 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 126.458 1.903 . . . . 0.0 112.617 175.192 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -70.03 -15.1 62.96 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.674 0.79 . . . . 0.0 112.128 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 33.7 m170 -132.1 153.38 81.32 Favored Pre-proline 0 CA--C 1.551 1.017 0 C-N-CA 124.402 1.081 . . . . 0.0 108.588 178.177 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.621 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 60.9 Cg_endo -78.82 -166.23 0.39 Allowed 'Trans proline' 0 C--N 1.379 2.141 0 C-N-CA 123.124 2.549 . . . . 0.0 113.67 -175.238 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.415 HD13 ' HB2' ' A' ' 29' ' ' LYS . 91.3 mt -96.9 146.07 7.99 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.696 0 C-N-CA 124.733 1.213 . . . . 0.0 109.313 174.185 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 28.1 t -141.96 -14.7 0.81 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 123.132 0.573 . . . . 0.0 111.805 176.974 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -130.95 134.21 46.52 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.135 0.574 . . . . 0.0 110.836 -174.792 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.485 ' HB ' ' HB2' ' A' ' 58' ' ' TRP . 7.3 p -115.85 140.34 38.14 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 124.041 0.937 . . . . 0.0 110.288 176.227 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -84.71 89.6 7.54 Favored 'General case' 0 C--O 1.242 0.66 0 C-N-CA 124.454 1.101 . . . . 0.0 108.471 175.217 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.4 ' HB3' ' HB3' ' A' ' 54' ' ' SER . 35.7 tt0 -82.18 140.77 45.95 Favored Pre-proline 0 CA--C 1.552 1.034 0 C-N-CA 124.325 1.05 . . . . 0.0 109.988 -177.058 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 14.9 Cg_endo -97.95 31.15 12.26 Favored 'Cis proline' 0 C--N 1.384 2.4 0 CA-C-N 120.226 1.116 . . . . 0.0 114.195 1.743 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 43.5 t -75.02 -40.91 60.26 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -177.656 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 85.52 23.64 46.31 Favored Glycine 0 C--N 1.345 1.045 0 C-N-CA 121.619 -0.324 . . . . 0.0 113.655 -176.979 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.502 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 24.8 m170 -104.59 147.84 27.18 Favored 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 166.812 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.432 ' HG3' HG23 ' A' ' 22' ' ' VAL . 6.3 mptt -132.41 169.47 16.48 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-O 121.602 0.715 . . . . 0.0 112.126 -171.039 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 84.3 p -169.19 -166.43 0.62 Allowed 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.664 1.586 . . . . 0.0 107.594 170.225 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 19.0 p -89.37 154.42 20.08 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 168.248 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.9 -33.99 72.6 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.415 0.686 . . . . 0.0 110.859 -176.551 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -54.88 -40.54 69.85 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.9 0.88 . . . . 0.0 112.52 177.519 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 9.0 m -62.01 -54.56 39.91 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.553 0.741 . . . . 0.0 111.21 178.577 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.411 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 9.5 tp -69.53 -32.55 53.28 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 O-C-N 123.055 0.222 . . . . 0.0 110.739 -175.935 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 4.6 t30 -58.77 -48.03 82.66 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.643 0.777 . . . . 0.0 110.626 176.954 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -62.46 -42.18 99.3 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 114.866 -1.061 . . . . 0.0 111.014 176.117 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 52.2 t60 -63.49 -38.52 91.45 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.695 0.798 . . . . 0.0 111.049 -178.749 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.411 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 96.1 mt -69.81 -11.29 60.74 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.809 0.844 . . . . 0.0 112.051 -177.116 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 45.6 mtm -76.48 -15.22 59.95 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 122.821 0.448 . . . . 0.0 111.059 172.545 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 19.3 m-80 -121.09 -64.91 1.19 Allowed 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 124.463 1.105 . . . . 0.0 110.376 -173.726 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 31.1 m-80 -126.81 -174.42 3.13 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 124.842 1.257 . . . . 0.0 109.468 -177.376 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp -137.18 68.89 1.41 Allowed 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 178.063 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.1 m-20 -139.21 165.79 26.24 Favored 'General case' 0 N--CA 1.494 1.726 0 CA-C-O 121.908 0.861 . . . . 0.0 112.076 -168.616 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.502 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 43.7 t -89.67 24.32 2.37 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 125.154 1.382 . . . . 0.0 112.239 -172.03 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 58.93 -86.0 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 125.158 1.383 . . . . 0.0 112.495 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -67.64 -40.39 84.59 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 125.407 1.483 . . . . 0.0 111.382 -162.239 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 7.5 p -108.74 -2.48 18.56 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.181 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 64.5 tttp 66.97 -2.27 1.19 Allowed 'General case' 0 CA--C 1.565 1.526 0 N-CA-C 114.657 1.355 . . . . 0.0 114.657 174.054 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 24.2 m -55.77 124.29 17.02 Favored 'General case' 0 N--CA 1.489 1.523 0 CA-C-N 119.16 0.891 . . . . 0.0 111.112 178.671 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 89.2 m -57.28 134.54 56.05 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.289 0.635 . . . . 0.0 111.674 -178.549 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 48.8 mm -62.38 118.67 4.95 Favored 'Isoleucine or valine' 0 C--N 1.354 0.768 0 C-N-CA 123.511 0.724 . . . . 0.0 110.732 -176.241 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 59.9 t -90.92 -40.33 12.54 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 172.896 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.4 ' HB3' ' HB3' ' A' ' 24' ' ' GLN . 24.9 t -154.35 146.79 23.98 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.49 0.716 . . . . 0.0 110.148 179.061 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 66.0 t -112.66 103.19 15.05 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 168.59 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -97.25 156.36 16.46 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.528 0.731 . . . . 0.0 109.114 178.046 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -75.65 107.7 7.98 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 170.007 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' TRP . . . . . 0.485 ' HB2' ' HB ' ' A' ' 22' ' ' VAL . 39.3 t90 . . . . . 0 C--O 1.241 0.651 0 O-C-N 123.237 0.336 . . . . 0.0 110.21 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.612 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 92.8 mt . . . . . 0 N--CA 1.47 0.538 0 CA-C-O 120.513 0.197 . . . . 0.0 111.256 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 42.5 t -61.61 119.26 45.66 Favored Pre-proline 0 N--CA 1.475 0.794 0 CA-C-O 118.744 -0.646 . . . . 0.0 110.37 178.223 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -67.0 -11.49 32.46 Favored 'Trans proline' 0 C--N 1.376 2.023 0 C-N-CA 122.746 2.297 . . . . 0.0 113.208 -177.748 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 68.4 mt -97.73 -28.41 3.69 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.153 0 C-N-CA 124.52 1.128 . . . . 0.0 111.886 -176.127 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 71.1 m -115.81 -38.87 3.59 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 122.841 0.456 . . . . 0.0 110.807 -173.188 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 11.0 t80 79.98 -54.77 0.38 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 126.703 2.001 . . . . 0.0 111.802 175.166 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.5 -38.95 85.99 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 124.084 0.953 . . . . 0.0 112.797 -175.619 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 65.2 m170 -103.88 153.93 38.42 Favored Pre-proline 0 N--CA 1.486 1.371 0 C-N-CA 123.712 0.805 . . . . 0.0 110.445 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.612 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 97.9 Cg_endo -75.27 -167.83 0.47 Allowed 'Trans proline' 0 C--N 1.38 2.221 0 C-N-CA 123.077 2.518 . . . . 0.0 113.597 -177.361 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.538 HG21 ' HB3' ' A' ' 29' ' ' LYS . 38.8 mt -96.94 147.29 6.41 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 C-N-CA 124.005 0.922 . . . . 0.0 109.938 174.676 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 34.3 p -154.87 25.12 0.44 Allowed 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.995 0.918 . . . . 0.0 110.542 179.141 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -152.56 141.81 21.47 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 124.167 0.987 . . . . 0.0 110.031 178.051 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 6.4 p -137.18 118.99 18.78 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 C-N-CA 124.236 1.014 . . . . 0.0 108.442 176.515 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -85.02 92.95 8.47 Favored 'General case' 0 C--O 1.244 0.812 0 N-CA-C 108.423 -0.955 . . . . 0.0 108.423 -174.907 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -83.42 152.62 64.49 Favored Pre-proline 0 CA--C 1.545 0.753 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.498 -178.167 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -89.78 18.12 39.52 Favored 'Cis proline' 0 C--N 1.38 2.223 0 N-CA-C 114.297 0.845 . . . . 0.0 114.297 0.413 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 36.6 t -65.4 -64.59 0.83 Allowed 'General case' 0 C--N 1.356 0.871 0 C-N-CA 123.064 0.545 . . . . 0.0 111.84 -176.549 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 125.67 -19.73 6.58 Favored Glycine 0 C--N 1.345 1.062 0 CA-C-O 118.951 -0.916 . . . . 0.0 113.465 -176.737 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.455 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 20.7 m-70 -61.01 144.41 53.45 Favored 'General case' 0 N--CA 1.487 1.409 0 CA-C-N 117.733 0.766 . . . . 0.0 110.494 176.728 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.538 ' HB3' HG21 ' A' ' 19' ' ' ILE . 58.3 mttp -136.48 157.45 46.75 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 123.876 0.87 . . . . 0.0 110.798 -170.534 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 94.6 p -169.04 179.55 4.0 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.86 1.264 . . . . 0.0 108.556 171.739 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 14.4 p -68.12 142.17 55.86 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 171.343 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.99 -21.65 66.29 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -175.104 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -58.63 -38.47 78.14 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.881 0.873 . . . . 0.0 111.329 173.247 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.8 m -58.59 -55.63 32.53 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 124.07 0.948 . . . . 0.0 111.592 177.359 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.53 HG12 HG21 ' A' ' 55' ' ' VAL . 9.2 tp -73.6 -33.86 40.19 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 O-C-N 123.422 0.451 . . . . 0.0 111.19 -173.269 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -62.96 -41.03 99.41 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-O 120.944 0.402 . . . . 0.0 110.429 175.79 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -74.88 -28.67 60.74 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 123.685 0.794 . . . . 0.0 110.915 176.707 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 83.2 t60 -69.79 -45.81 67.15 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.841 0.856 . . . . 0.0 110.417 -178.259 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 97.4 mt -60.82 -19.08 59.06 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 124.083 0.953 . . . . 0.0 112.656 -176.356 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 84.4 mmm -61.56 -32.59 72.67 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.37 1.068 . . . . 0.0 112.002 173.651 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 77.3 m-20 -116.4 -58.24 2.11 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.34 0.656 . . . . 0.0 111.134 -176.787 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -122.71 160.66 25.41 Favored 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 124.144 0.977 . . . . 0.0 110.947 -176.936 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 47.6 mtpt -126.46 63.66 1.27 Allowed 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 174.844 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -128.59 158.12 39.37 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 115.136 -0.938 . . . . 0.0 109.944 -174.971 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.455 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 42.3 t -87.7 37.37 0.79 Allowed 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 123.675 0.79 . . . . 0.0 111.875 -176.396 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 57.6 -85.3 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 125.697 1.599 . . . . 0.0 112.775 173.97 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 -74.82 -39.07 61.86 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.639 1.176 . . . . 0.0 111.758 -165.217 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 14.2 p -107.05 -2.53 20.97 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 122.952 0.501 . . . . 0.0 110.994 -179.875 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 83.8 tttt 66.39 -4.18 0.74 Allowed 'General case' 0 CA--C 1.566 1.582 0 C-N-CA 125.492 1.517 . . . . 0.0 114.917 176.841 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 22.9 m -51.11 121.16 5.7 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 119.27 0.941 . . . . 0.0 111.128 -177.299 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 20.6 m -51.6 127.84 21.49 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.393 0.677 . . . . 0.0 110.772 -177.077 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.454 HG13 HD11 ' A' ' 35' ' ' ILE . 42.4 mm -60.71 103.28 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.353 0.724 0 O-C-N 123.756 0.66 . . . . 0.0 110.64 -175.542 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 47.4 t -75.76 -55.4 11.5 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 CA-C-N 115.047 -0.979 . . . . 0.0 108.44 174.207 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.8 t -153.57 153.06 31.66 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 123.128 0.571 . . . . 0.0 110.582 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.53 HG21 HG12 ' A' ' 35' ' ' ILE . 58.1 t -127.53 127.13 68.43 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 124.532 1.133 . . . . 0.0 108.462 175.428 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -108.64 143.72 37.34 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.599 0.76 . . . . 0.0 109.055 173.128 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -66.13 106.21 1.58 Allowed 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 108.428 -0.952 . . . . 0.0 108.428 174.313 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 72.1 t90 . . . . . 0 CA--C 1.541 0.613 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 177.209 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.739 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 94.6 mt . . . . . 0 C--O 1.236 0.379 0 CA-C-O 121.283 0.563 . . . . 0.0 111.777 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.42 ' SG ' ' HB ' ' A' ' 13' ' ' ILE . 51.0 t -67.15 114.34 17.97 Favored Pre-proline 0 CA--C 1.545 0.759 0 CA-C-N 114.413 -1.267 . . . . 0.0 109.223 171.583 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -64.0 -8.28 15.66 Favored 'Trans proline' 0 C--N 1.374 1.897 0 C-N-CA 122.814 2.343 . . . . 0.0 113.353 -179.324 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.42 ' HB ' ' SG ' ' A' ' 11' ' ' CYS . 3.6 mp -84.52 -44.98 17.9 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.989 0 C-N-CA 124.186 0.994 . . . . 0.0 110.172 175.258 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 78.8 m -107.39 -46.87 3.76 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.348 0.659 . . . . 0.0 112.688 -165.885 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 97.6 m-85 76.81 -39.17 0.33 Allowed 'General case' 0 N--CA 1.499 2.012 0 C-N-CA 126.196 1.798 . . . . 0.0 113.419 178.337 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.75 -20.58 65.25 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.371 0.668 . . . . 0.0 112.797 -177.293 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 80.3 m-70 -134.72 152.74 78.14 Favored Pre-proline 0 C--O 1.248 0.977 0 C-N-CA 123.728 0.811 . . . . 0.0 109.371 -179.14 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.739 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 83.0 Cg_endo -72.66 -166.07 0.26 Allowed 'Trans proline' 0 C--N 1.38 2.224 0 C-N-CA 122.925 2.417 . . . . 0.0 113.822 -178.291 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.604 HG21 ' HB3' ' A' ' 29' ' ' LYS . 92.4 mt -94.64 146.0 7.33 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 C-N-CA 124.469 1.108 . . . . 0.0 108.63 172.922 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 18.9 t -147.33 9.36 0.95 Allowed 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.172 0.589 . . . . 0.0 110.922 178.26 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.412 ' HA ' ' HA ' ' A' ' 57' ' ' ASP . . . -142.29 141.96 32.48 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.173 0.589 . . . . 0.0 110.677 -179.014 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.1 p -119.35 136.99 54.73 Favored 'Isoleucine or valine' 0 C--O 1.245 0.83 0 C-N-CA 124.08 0.952 . . . . 0.0 109.491 177.763 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.408 ' HB3' HG12 ' A' ' 52' ' ' ILE . 10.3 m-30 -98.63 87.44 3.8 Favored 'General case' 0 C--O 1.241 0.644 0 C-N-CA 123.877 0.871 . . . . 0.0 109.057 -177.134 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 17.0 mt-30 -81.9 147.6 58.73 Favored Pre-proline 0 CA--C 1.546 0.803 0 CA-C-N 115.217 -0.901 . . . . 0.0 111.383 -176.403 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.497 ' HD3' ' HB ' ' A' ' 53' ' ' VAL . 43.6 Cg_endo -97.44 24.36 22.42 Favored 'Cis proline' 0 C--N 1.374 1.871 0 C-N-CA 125.322 -0.699 . . . . 0.0 113.384 -0.267 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 37.5 t -71.53 -49.37 41.49 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 122.696 0.398 . . . . 0.0 110.759 -179.102 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 108.79 -12.66 35.12 Favored Glycine 0 C--N 1.348 1.229 0 CA-C-O 119.429 -0.651 . . . . 0.0 114.032 179.119 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.414 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 11.1 m80 -64.53 143.51 57.86 Favored 'General case' 0 N--CA 1.484 1.269 0 CA-C-N 117.391 0.596 . . . . 0.0 110.351 173.487 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.604 ' HB3' HG21 ' A' ' 19' ' ' ILE . 96.2 mttt -135.54 149.6 49.51 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.632 0.773 . . . . 0.0 110.844 -168.831 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 47.2 t -157.64 173.75 16.38 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.253 1.021 . . . . 0.0 109.069 178.785 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 12.3 p -68.0 146.87 53.13 Favored 'General case' 0 C--O 1.243 0.757 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 176.161 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt -61.78 -28.25 69.32 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.456 0.702 . . . . 0.0 111.777 -174.479 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -62.68 -42.18 99.49 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.765 0.826 . . . . 0.0 111.933 178.798 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.1 m -56.09 -56.21 23.65 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.315 0.646 . . . . 0.0 111.271 178.408 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.443 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 7.7 tp -73.67 -34.37 41.08 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.75 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.285 -173.767 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -56.85 -46.76 81.56 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 123.294 0.637 . . . . 0.0 110.429 177.054 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -66.41 -40.64 89.71 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.68 176.271 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 82.5 t60 -74.16 -24.28 59.37 Favored 'General case' 0 C--O 1.215 -0.754 0 CA-C-N 115.272 -0.877 . . . . 0.0 112.722 -172.414 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.443 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 73.2 mt -61.95 -22.41 65.6 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 122.985 0.514 . . . . 0.0 111.976 -179.143 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 24.6 mmt -75.34 -31.14 60.47 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 123.697 0.799 . . . . 0.0 110.643 174.241 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 23.6 m-20 -84.18 -76.33 0.3 Allowed 'General case' 0 CA--C 1.553 1.058 0 C-N-CA 123.937 0.895 . . . . 0.0 109.251 177.895 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -141.45 -167.23 2.37 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 125.198 1.399 . . . . 0.0 109.641 -176.686 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -141.98 87.72 2.06 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 173.516 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -152.17 162.42 41.15 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.062 179.564 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.414 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 79.3 m -62.18 142.33 57.7 Favored 'General case' 0 C--N 1.347 0.465 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.206 173.605 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 71.1 m-85 -82.86 26.34 0.6 Allowed 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.379 0.672 . . . . 0.0 110.271 172.796 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 48.4 m-85 -139.38 -77.2 0.34 Allowed 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 124.21 1.004 . . . . 0.0 108.93 -169.11 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.475 ' HG ' ' HG1' ' A' ' 50' ' ' THR . 1.8 p -95.07 -1.86 51.28 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.178 0.591 . . . . 0.0 111.394 -177.388 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 8.6 mtmp? 63.78 9.54 4.5 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 125.04 1.336 . . . . 0.0 113.928 176.598 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.475 ' HG1' ' HG ' ' A' ' 48' ' ' CYS . 87.4 m -65.6 128.84 37.57 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.236 0.614 . . . . 0.0 111.116 177.351 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 56.9 m -58.16 133.64 55.79 Favored 'General case' 0 C--N 1.352 0.695 0 O-C-N 124.456 1.098 . . . . 0.0 111.512 178.306 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.451 HG21 HG22 ' A' ' 55' ' ' VAL . 30.8 mt -86.6 119.9 35.33 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 C-N-CA 123.907 0.883 . . . . 0.0 109.716 -177.621 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.497 ' HB ' ' HD3' ' A' ' 25' ' ' PRO . 61.1 t -78.91 -35.46 17.86 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.922 0 C-N-CA 123.096 0.558 . . . . 0.0 109.96 178.85 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.7 t -145.91 131.7 19.03 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 122.941 0.496 . . . . 0.0 110.331 175.46 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.451 HG22 HG21 ' A' ' 52' ' ' ILE . 56.6 t -100.48 111.89 31.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 175.771 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -117.71 -178.52 3.5 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 123.095 0.558 . . . . 0.0 110.179 174.544 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ASP . . . . . 0.412 ' HA ' ' HA ' ' A' ' 21' ' ' ALA . 35.9 m-20 -100.05 164.37 12.02 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.589 0.756 . . . . 0.0 109.947 178.446 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 54.7 t90 . . . . . 0 N--CA 1.465 0.303 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 179.594 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.567 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 59.6 mt . . . . . 0 C--O 1.236 0.353 0 N-CA-C 110.577 -0.157 . . . . 0.0 110.577 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 46.1 t -50.19 114.78 4.69 Favored Pre-proline 0 CA--C 1.546 0.825 0 O-C-N 124.387 1.054 . . . . 0.0 109.869 179.445 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_exo -57.55 -14.33 16.45 Favored 'Trans proline' 0 C--N 1.38 2.236 0 C-N-CA 123.352 2.701 . . . . 0.0 114.358 -172.778 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.6 mp -89.51 -42.47 14.4 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.253 0 C-N-CA 124.272 1.029 . . . . 0.0 110.047 177.507 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 79.8 m -102.12 -55.03 2.57 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.599 0.76 . . . . 0.0 112.688 -169.04 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.502 ' HA ' ' HB3' ' A' ' 10' ' ' LEU . 96.0 m-85 77.09 -32.29 0.18 Allowed 'General case' 0 N--CA 1.495 1.804 0 C-N-CA 126.318 1.847 . . . . 0.0 113.345 -178.528 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.5 -36.91 79.48 Favored 'General case' 0 N--CA 1.484 1.25 0 CA-C-N 118.564 0.62 . . . . 0.0 111.917 -179.152 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 10.9 m170 -127.07 155.14 76.42 Favored Pre-proline 0 N--CA 1.482 1.145 0 C-N-CA 124.441 1.097 . . . . 0.0 109.139 178.77 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.567 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 92.6 Cg_endo -76.91 -159.6 0.1 Allowed 'Trans proline' 0 C--N 1.376 2.023 0 C-N-CA 122.707 2.272 . . . . 0.0 113.936 179.379 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.442 HG21 ' HB3' ' A' ' 29' ' ' LYS . 83.0 mt -78.58 138.0 20.95 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.799 0 C-N-CA 124.285 1.034 . . . . 0.0 110.906 177.504 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.2 m -110.8 -27.77 8.71 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.568 0.747 . . . . 0.0 110.731 176.935 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.457 ' HB1' HG12 ' A' ' 55' ' ' VAL . . . -147.58 154.16 40.34 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.096 0.558 . . . . 0.0 111.778 -166.097 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 5.7 p -123.46 124.81 70.51 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.95 0 C-N-CA 124.552 1.141 . . . . 0.0 109.851 179.311 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -77.41 94.7 4.28 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.12 0.968 . . . . 0.0 108.97 178.55 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 -98.09 155.46 36.98 Favored Pre-proline 0 CA--C 1.546 0.823 0 C-N-CA 123.054 0.542 . . . . 0.0 111.14 -174.603 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -85.72 18.89 27.95 Favored 'Cis proline' 0 C--N 1.383 2.378 0 N-CA-C 115.049 1.134 . . . . 0.0 115.049 3.342 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 53.4 t -67.8 -65.07 0.74 Allowed 'General case' 0 C--N 1.354 0.765 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -177.901 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 124.93 -16.87 7.25 Favored Glycine 0 C--N 1.35 1.313 0 CA-C-O 119.13 -0.817 . . . . 0.0 114.211 179.5 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.569 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 57.1 m-70 -63.94 149.14 47.89 Favored 'General case' 0 N--CA 1.482 1.146 0 CA-C-N 117.644 0.722 . . . . 0.0 110.206 171.987 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.442 ' HB3' HG21 ' A' ' 19' ' ' ILE . 83.1 mttt -137.22 161.58 35.82 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 123.703 0.801 . . . . 0.0 110.77 -168.324 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 38.3 t -172.98 178.65 2.48 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.847 1.259 . . . . 0.0 108.714 178.344 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 13.6 p -79.36 153.11 30.01 Favored 'General case' 0 C--O 1.246 0.9 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 173.787 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt -67.19 -23.6 65.77 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.289 0.636 . . . . 0.0 111.767 -173.353 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.51 -42.29 92.22 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.744 0.818 . . . . 0.0 111.553 177.963 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 8.7 m -56.78 -54.5 45.63 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.447 0.699 . . . . 0.0 110.851 176.429 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.531 HG12 HG21 ' A' ' 55' ' ' VAL . 9.8 tp -74.97 -23.36 17.39 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.982 0 O-C-N 123.688 0.617 . . . . 0.0 111.11 -174.67 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -62.56 -55.41 27.49 Favored 'General case' 0 N--CA 1.487 1.414 0 CA-C-O 121.505 0.669 . . . . 0.0 109.868 173.831 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 61.0 tt0 -70.44 -19.55 62.96 Favored 'General case' 0 CA--C 1.553 1.06 0 CA-C-N 114.519 -1.219 . . . . 0.0 111.063 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 62.7 t60 -81.51 -41.74 21.25 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.347 0.659 . . . . 0.0 111.367 178.685 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 48.9 mt -66.85 -24.49 66.15 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.122 0.569 . . . . 0.0 112.527 -173.445 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 27.3 ptm -69.99 -21.21 63.25 Favored 'General case' 0 N--CA 1.482 1.174 0 CA-C-O 120.576 0.226 . . . . 0.0 110.957 175.315 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 66.0 m-20 -106.02 -73.86 0.67 Allowed 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.882 0.873 . . . . 0.0 109.749 -179.041 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -111.68 -174.57 2.49 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 124.545 1.138 . . . . 0.0 110.491 -176.736 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 22.1 ttmm -139.82 15.64 2.49 Favored 'General case' 0 N--CA 1.486 1.33 0 CA-C-O 121.484 0.659 . . . . 0.0 110.665 179.63 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -88.86 164.17 15.31 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-O 121.326 0.584 . . . . 0.0 111.408 -174.469 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.569 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 43.5 t -91.66 32.87 1.05 Allowed 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 124.526 1.13 . . . . 0.0 112.664 -172.427 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 57.7 -83.46 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 125.231 1.413 . . . . 0.0 112.646 174.833 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -67.55 -24.96 65.59 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 125.505 1.522 . . . . 0.0 112.735 -167.022 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 15.2 p -131.03 -7.48 3.9 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 122.93 0.492 . . . . 0.0 111.195 -176.784 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 55.2 tttm 64.48 11.91 6.96 Favored 'General case' 0 CA--C 1.569 1.691 0 C-N-CA 124.784 1.234 . . . . 0.0 113.548 177.002 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 26.7 m -62.86 133.7 55.1 Favored 'General case' 0 N--CA 1.481 1.088 0 O-C-N 121.407 -0.808 . . . . 0.0 110.451 176.412 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 23.8 m -60.79 119.84 8.96 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.112 0.565 . . . . 0.0 110.323 179.385 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.483 HG21 HG22 ' A' ' 55' ' ' VAL . 46.6 mt -79.54 122.2 34.29 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 O-C-N 123.454 0.471 . . . . 0.0 109.754 -179.68 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 46.2 t -81.53 -38.53 16.3 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 C-N-CA 123.208 0.603 . . . . 0.0 109.553 175.846 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 34.2 p -168.11 136.97 2.41 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.706 0.803 . . . . 0.0 110.713 175.615 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.531 HG21 HG12 ' A' ' 35' ' ' ILE . 21.7 t -96.72 113.56 31.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 123.87 0.868 . . . . 0.0 109.254 178.064 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.1 mm-40 -85.24 172.86 10.82 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 110.073 -0.343 . . . . 0.0 110.073 175.313 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -87.52 135.56 33.3 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 174.212 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 73.4 t90 . . . . . 0 N--CA 1.477 0.906 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 175.698 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.611 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 93.3 mt . . . . . 0 N--CA 1.479 1.023 0 N-CA-C 110.617 -0.142 . . . . 0.0 110.617 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.463 ' HB3' ' HB2' ' A' ' 14' ' ' CYS . 42.4 t -66.74 116.42 34.77 Favored Pre-proline 0 CA--C 1.552 1.041 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 175.468 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_endo -58.23 -17.28 31.78 Favored 'Trans proline' 0 C--N 1.382 2.321 0 C-N-CA 123.417 2.745 . . . . 0.0 114.119 -174.683 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 73.3 mt -88.17 -45.88 15.81 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.885 0 C-N-CA 123.882 0.873 . . . . 0.0 110.788 176.544 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.463 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . 86.3 m -90.76 -55.58 3.51 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.126 0.57 . . . . 0.0 111.73 -167.861 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 84.3 m-85 74.84 -43.32 0.52 Allowed 'General case' 0 N--CA 1.494 1.743 0 C-N-CA 126.285 1.834 . . . . 0.0 111.872 -174.426 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.3 -30.6 71.26 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 124.004 0.921 . . . . 0.0 112.372 -178.752 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 21.7 m-70 -124.4 151.23 66.35 Favored Pre-proline 0 N--CA 1.479 1.016 0 C-N-CA 124.047 0.939 . . . . 0.0 109.521 176.998 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.611 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 13.1 Cg_exo -71.36 -164.55 0.16 Allowed 'Trans proline' 0 C--N 1.381 2.259 0 C-N-CA 123.898 3.066 . . . . 0.0 114.086 -177.075 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 83.2 mt -86.51 129.93 37.52 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.84 0 C-N-CA 123.466 0.706 . . . . 0.0 110.065 175.726 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 25.8 t -132.46 6.44 4.11 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 123.876 0.87 . . . . 0.0 110.875 178.733 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -154.95 160.93 41.48 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-O 121.343 0.592 . . . . 0.0 111.413 -178.279 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 4.7 p -145.71 139.76 21.52 Favored 'Isoleucine or valine' 0 C--O 1.244 0.781 0 C-N-CA 124.863 1.265 . . . . 0.0 108.752 177.923 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -96.79 88.11 4.5 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 178.125 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 16.1 mt-30 -84.95 149.41 53.24 Favored Pre-proline 0 C--O 1.242 0.704 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.359 -176.407 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -92.29 22.38 29.34 Favored 'Cis proline' 0 C--N 1.383 2.368 0 N-CA-C 114.776 1.029 . . . . 0.0 114.776 2.209 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 35.3 t -69.13 -50.12 50.85 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 122.767 0.427 . . . . 0.0 111.555 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 105.58 -6.08 41.23 Favored Glycine 0 C--N 1.343 0.96 0 CA-C-O 118.967 -0.907 . . . . 0.0 114.619 177.867 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.437 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 7.6 m-70 -62.99 128.14 34.47 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 117.662 0.731 . . . . 0.0 110.016 173.958 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -101.21 156.82 17.21 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.219 1.008 . . . . 0.0 110.897 -174.049 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 79.9 p -168.72 -157.34 0.19 Allowed 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.415 1.086 . . . . 0.0 108.257 175.176 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 30.8 p -116.44 161.19 19.46 Favored 'General case' 0 C--O 1.247 0.964 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 170.179 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 57.5 mtpt -57.07 -40.17 76.39 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 123.494 0.718 . . . . 0.0 111.12 -179.295 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -53.83 -42.13 68.12 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 123.918 0.887 . . . . 0.0 113.086 179.197 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 8.7 m -60.32 -56.63 19.1 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.653 0.781 . . . . 0.0 111.274 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.422 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 8.6 tp -72.92 -35.36 48.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.519 -171.901 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -61.29 -47.45 85.91 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.207 0.603 . . . . 0.0 111.279 177.96 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 37.0 tt0 -62.94 -34.38 77.35 Favored 'General case' 0 CA--C 1.554 1.102 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.657 176.958 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 84.8 t60 -73.56 -37.51 65.52 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.274 1.03 . . . . 0.0 112.477 -178.334 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 77.8 mt -64.6 -17.56 64.11 Favored 'General case' 0 N--CA 1.492 1.644 0 C-N-CA 123.505 0.722 . . . . 0.0 112.569 -174.942 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 87.1 mtp -66.86 -29.16 68.99 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.297 0.639 . . . . 0.0 111.021 174.271 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 31.5 t30 -105.15 -72.89 0.69 Allowed 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 123.91 0.884 . . . . 0.0 110.269 177.998 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 79.3 m-20 -115.98 164.61 14.17 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.45 0.7 . . . . 0.0 110.783 -173.873 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -124.51 45.65 2.47 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.065 0.946 . . . . 0.0 108.93 176.804 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -109.18 168.65 9.22 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.498 177.547 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.437 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 41.6 t -93.61 32.5 1.39 Allowed 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 124.668 1.187 . . . . 0.0 111.922 -171.414 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 59.4 -84.35 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 125.616 1.566 . . . . 0.0 112.287 175.817 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 16.4 m-85 -70.6 -32.98 70.54 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.879 1.272 . . . . 0.0 112.05 -164.606 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 14.8 p -119.53 -6.2 10.24 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 122.926 0.49 . . . . 0.0 111.161 -178.109 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 55.4 mtpt 60.28 18.69 8.21 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 114.82 1.415 . . . . 0.0 114.82 178.559 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 45.6 m -62.9 137.1 58.18 Favored 'General case' 0 N--CA 1.48 1.053 0 CA-C-N 118.173 0.442 . . . . 0.0 109.936 174.081 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 29.0 m -58.15 129.64 42.93 Favored 'General case' 0 C--O 1.246 0.9 0 C-N-CA 123.24 0.616 . . . . 0.0 110.331 177.69 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 41.9 mm -66.64 102.01 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.814 0 O-C-N 123.724 0.64 . . . . 0.0 109.724 179.046 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 97.7 t -73.16 -37.69 53.17 Favored 'Isoleucine or valine' 0 C--O 1.242 0.687 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 172.071 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.8 p -158.57 133.21 8.17 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.455 174.521 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 48.5 t -90.37 116.99 32.75 Favored 'Isoleucine or valine' 0 C--N 1.353 0.73 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 163.901 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -122.63 135.55 54.64 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 177.915 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -60.92 159.16 11.81 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.665 0.786 . . . . 0.0 110.201 173.344 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 37.3 t90 . . . . . 0 CA--C 1.538 0.483 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 -177.138 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.511 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 74.4 mt . . . . . 0 N--CA 1.476 0.867 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 52.5 t -57.2 114.93 9.09 Favored Pre-proline 0 CA--C 1.55 0.952 0 O-C-N 124.308 1.005 . . . . 0.0 108.868 174.143 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -57.35 -19.84 37.13 Favored 'Trans proline' 0 N--CA 1.508 2.361 0 C-N-CA 123.373 2.716 . . . . 0.0 114.185 -175.172 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.8 mp -80.02 -26.76 12.04 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.468 0 C-N-CA 124.269 1.028 . . . . 0.0 110.774 -176.857 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 40.4 m -133.33 -42.06 0.87 Allowed 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 113.256 0.836 . . . . 0.0 113.256 -161.162 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 93.1 m-85 77.94 -37.64 0.24 Allowed 'General case' 0 N--CA 1.496 1.846 0 C-N-CA 126.248 1.819 . . . . 0.0 113.108 178.953 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -74.59 -6.95 51.44 Favored 'General case' 0 CA--C 1.555 1.156 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 -169.032 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 66.9 m-70 -141.49 137.72 16.74 Favored Pre-proline 0 N--CA 1.494 1.734 0 CA-C-N 118.658 0.663 . . . . 0.0 109.936 174.634 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.511 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 47.2 Cg_endo -88.62 80.69 0.94 Allowed 'Trans proline' 0 C--N 1.383 2.355 0 C-N-CA 123.429 2.753 . . . . 0.0 114.027 -178.725 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 64.7 mt 63.07 155.5 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.037 0 C-N-CA 124.948 1.299 . . . . 0.0 111.957 -178.945 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.416 ' HB3' ' H ' ' A' ' 32' ' ' LYS . 26.3 t -159.81 -7.6 0.06 Allowed 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 122.696 0.398 . . . . 0.0 111.766 173.126 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -152.03 132.52 13.83 Favored 'General case' 0 N--CA 1.481 1.083 0 CA-C-N 118.348 0.522 . . . . 0.0 111.144 -175.693 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.2 p -102.41 132.89 47.53 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.88 0 C-N-CA 124.231 1.013 . . . . 0.0 109.834 173.916 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -93.71 100.11 12.39 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.118 -178.879 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 -90.02 151.47 45.14 Favored Pre-proline 0 CA--C 1.545 0.759 0 C-N-CA 123.61 0.764 . . . . 0.0 110.92 178.07 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_endo -92.44 32.21 10.7 Favored 'Cis proline' 0 C--N 1.376 2.011 0 CA-C-N 118.528 0.51 . . . . 0.0 113.112 3.436 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.7 t -83.49 -72.83 0.44 Allowed 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 122.67 0.388 . . . . 0.0 111.246 -179.826 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 133.67 -30.4 2.99 Favored Glycine 0 C--N 1.349 1.254 0 CA-C-O 119.696 -0.502 . . . . 0.0 112.674 -176.028 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 20.1 m170 -57.29 132.3 52.62 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 123.385 0.674 . . . . 0.0 110.717 175.536 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 50.3 mttp -115.52 150.66 36.2 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.152 0.981 . . . . 0.0 110.44 -175.847 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 54.5 p -142.13 -155.94 0.64 Allowed 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 166.168 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 22.3 p -99.41 162.09 13.24 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 118.312 0.506 . . . . 0.0 109.79 173.831 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.416 ' H ' ' HB3' ' A' ' 20' ' ' SER . 56.0 mtpt -63.58 -34.6 78.18 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.029 0.932 . . . . 0.0 111.282 -179.99 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.87 -32.51 70.78 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.42 0.688 . . . . 0.0 111.584 176.761 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.4 m -63.52 -55.39 24.35 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.507 0.723 . . . . 0.0 111.07 176.574 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.663 HG12 HG21 ' A' ' 55' ' ' VAL . 8.8 tp -69.75 -37.74 74.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 O-C-N 123.579 0.549 . . . . 0.0 110.95 -173.491 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -63.47 -38.44 91.15 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-O 121.134 0.492 . . . . 0.0 110.683 178.561 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -73.18 -32.69 64.98 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 123.538 0.735 . . . . 0.0 110.675 175.423 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 59.8 t60 -72.94 -32.5 65.32 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.86 0.864 . . . . 0.0 110.713 -176.948 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 97.4 mt -72.39 -7.42 49.6 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.864 0.866 . . . . 0.0 111.9 -179.072 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 92.9 mmm -74.31 -14.11 60.85 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 123.657 0.783 . . . . 0.0 110.851 168.315 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -131.37 -73.17 0.53 Allowed 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 124.131 0.972 . . . . 0.0 111.064 -175.943 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -126.79 -170.07 2.14 Favored 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 123.695 0.798 . . . . 0.0 111.177 -176.152 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -145.34 35.36 1.08 Allowed 'General case' 0 N--CA 1.476 0.825 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 176.964 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.506 ' HA ' ' HA ' ' A' ' 51' ' ' THR . 4.5 m-20 -99.16 156.82 16.76 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.144 -177.16 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.453 ' HB2' ' O ' ' A' ' 50' ' ' THR . 5.4 t -72.01 115.66 11.5 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 86.9 m-85 -49.42 -34.66 17.02 Favored 'General case' 0 N--CA 1.495 1.823 0 C-N-CA 123.989 0.916 . . . . 0.0 112.866 -177.175 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 77.6 m-85 -91.7 -28.04 17.69 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 115.2 -0.909 . . . . 0.0 112.777 -169.617 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 7.8 p -149.61 22.72 0.9 Allowed 'General case' 0 N--CA 1.496 1.857 0 N-CA-C 113.316 0.858 . . . . 0.0 113.316 -169.155 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 65.7 mttm 71.24 -28.22 0.18 Allowed 'General case' 0 N--CA 1.505 2.277 0 N-CA-C 115.671 1.73 . . . . 0.0 115.671 172.985 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.453 ' O ' ' HB2' ' A' ' 45' ' ' CYS . 7.7 m -57.43 114.25 2.13 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.75 0.82 . . . . 0.0 112.268 -169.483 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.506 ' HA ' ' HA ' ' A' ' 44' ' ' ASP . 24.8 m -57.48 123.67 16.3 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 123.369 0.668 . . . . 0.0 110.508 -179.63 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.546 HG21 HG22 ' A' ' 55' ' ' VAL . 12.2 mt -71.97 122.57 24.59 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 124.86 1.264 . . . . 0.0 109.515 -175.75 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 83.9 t -81.39 -34.31 13.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 C-N-CA 122.968 0.507 . . . . 0.0 109.842 178.43 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 24.5 t -156.29 135.7 12.28 Favored 'General case' 0 C--N 1.355 0.828 0 CA-C-O 120.935 0.397 . . . . 0.0 110.596 -179.058 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.663 HG21 HG12 ' A' ' 35' ' ' ILE . 31.6 t -108.83 106.78 21.35 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 123.682 0.793 . . . . 0.0 109.881 179.871 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -93.39 141.92 27.91 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 173.45 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -79.24 118.56 21.29 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 173.831 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 74.1 t90 . . . . . 0 C--O 1.238 0.451 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 -175.551 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.655 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 88.0 mt . . . . . 0 CA--C 1.536 0.428 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.613 ' SG ' ' HB2' ' A' ' 30' ' ' SER . 45.2 t -59.3 118.26 28.98 Favored Pre-proline 0 CA--C 1.548 0.899 0 CA-C-O 118.357 -0.83 . . . . 0.0 108.901 173.251 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_endo -60.55 -17.37 48.18 Favored 'Trans proline' 0 N--CA 1.507 2.3 0 C-N-CA 123.111 2.54 . . . . 0.0 112.848 -176.58 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 67.8 mt -86.53 -46.2 16.55 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.871 0 C-N-CA 124.925 1.29 . . . . 0.0 111.628 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 91.9 m -92.66 -38.39 11.88 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.253 0.621 . . . . 0.0 111.564 -170.357 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.431 ' O ' HD13 ' A' ' 10' ' ' LEU . 98.1 m-85 74.69 -44.64 0.56 Allowed 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 126.232 1.813 . . . . 0.0 112.976 179.56 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -76.76 -32.49 57.76 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.268 0.627 . . . . 0.0 112.667 -175.517 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 15.6 m-70 -112.64 153.28 45.06 Favored Pre-proline 0 N--CA 1.481 1.1 0 C-N-CA 123.875 0.87 . . . . 0.0 109.52 -175.475 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.655 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 64.6 Cg_endo -79.05 -170.89 1.1 Allowed 'Trans proline' 0 C--N 1.38 2.213 0 C-N-CA 123.124 2.549 . . . . 0.0 113.9 -174.395 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.494 HG21 ' HB3' ' A' ' 29' ' ' LYS . 97.4 mt -89.99 143.18 11.72 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 CA-C-N 114.792 -1.094 . . . . 0.0 109.968 176.841 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.6 m -142.29 13.42 2.0 Allowed 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.079 0.952 . . . . 0.0 110.841 179.698 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -155.78 136.26 13.24 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.711 0.805 . . . . 0.0 110.928 -175.588 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.7 p -122.02 126.99 75.2 Favored 'Isoleucine or valine' 0 C--O 1.24 0.564 0 C-N-CA 124.605 1.162 . . . . 0.0 108.45 172.329 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -92.98 88.65 6.22 Favored 'General case' 0 C--O 1.244 0.789 0 N-CA-C 108.133 -1.062 . . . . 0.0 108.133 -178.281 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -71.56 152.35 93.77 Favored Pre-proline 0 C--O 1.242 0.704 0 CA-C-N 114.035 -1.438 . . . . 0.0 111.863 -177.506 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_endo -92.48 28.9 15.83 Favored 'Cis proline' 0 C--N 1.375 1.955 0 C-N-CA 125.783 -0.507 . . . . 0.0 112.616 -9.43 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 53.6 t -77.24 -40.31 45.33 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.258 0.623 . . . . 0.0 111.551 -176.022 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 91.73 -6.34 79.79 Favored Glycine 0 C--N 1.343 0.942 0 CA-C-O 119.37 -0.683 . . . . 0.0 114.369 179.168 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.503 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 13.5 m170 -64.95 135.51 55.75 Favored 'General case' 0 N--CA 1.481 1.084 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 167.127 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.494 ' HB3' HG21 ' A' ' 19' ' ' ILE . 86.5 mttt -136.09 151.24 49.61 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.391 0.676 . . . . 0.0 110.644 -171.126 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.613 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 92.7 p -161.9 -173.93 3.92 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.486 1.114 . . . . 0.0 108.389 172.272 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 15.8 p -75.06 145.95 41.92 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 174.308 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -67.56 -19.81 65.32 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 122.951 0.5 . . . . 0.0 111.957 -173.456 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.78 -39.53 85.21 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 123.744 0.818 . . . . 0.0 111.536 171.408 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.8 m -61.74 -49.02 78.08 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.608 0.763 . . . . 0.0 111.721 178.364 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.516 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 9.7 tp -72.14 -36.68 57.24 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 O-C-N 123.116 0.26 . . . . 0.0 111.101 -173.36 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -64.11 -38.66 91.87 Favored 'General case' 0 CA--C 1.549 0.937 0 CA-C-O 121.126 0.488 . . . . 0.0 109.843 177.611 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.508 ' O ' ' HG2' ' A' ' 40' ' ' MET . 45.9 tt0 -69.75 -27.98 65.4 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 123.961 0.905 . . . . 0.0 110.767 173.661 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 78.3 t60 -83.59 -26.57 29.9 Favored 'General case' 0 C--O 1.21 -1.007 0 C-N-CA 123.281 0.632 . . . . 0.0 111.292 -177.303 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.575 HD22 ' HG3' ' A' ' 43' ' ' LYS . 88.0 mt -69.01 -30.77 69.24 Favored 'General case' 0 N--CA 1.486 1.338 0 CA-C-N 118.314 0.506 . . . . 0.0 111.328 -177.479 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.508 ' HG2' ' O ' ' A' ' 37' ' ' GLN . 25.1 ptt? -68.28 -21.03 64.81 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 122.402 0.281 . . . . 0.0 110.53 173.871 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 -88.3 -75.81 0.41 Allowed 'General case' 0 CA--C 1.558 1.279 0 C-N-CA 124.435 1.094 . . . . 0.0 109.412 175.34 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 48.4 m-80 -148.35 151.56 35.55 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 124.778 1.231 . . . . 0.0 109.673 178.162 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.575 ' HG3' HD22 ' A' ' 39' ' ' LEU . 13.5 mptt -90.63 62.04 5.03 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.592 0.757 . . . . 0.0 110.176 179.709 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -130.16 174.49 9.76 Favored 'General case' 0 N--CA 1.481 1.102 0 CA-C-O 121.423 0.63 . . . . 0.0 110.953 179.221 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.503 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 41.8 t -98.49 45.87 1.01 Allowed 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.63 1.172 . . . . 0.0 110.86 -172.45 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 57.39 -87.31 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 125.651 1.58 . . . . 0.0 113.031 172.092 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 73.0 m-85 -75.27 -37.34 60.97 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.923 1.289 . . . . 0.0 111.572 -165.288 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.47 ' HG ' ' HG1' ' A' ' 50' ' ' THR . 13.8 p -110.12 -9.43 14.71 Favored 'General case' 0 N--CA 1.482 1.153 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.432 -172.372 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 99.0 mttt 60.57 30.55 19.83 Favored 'General case' 0 N--CA 1.492 1.626 0 C-N-CA 124.502 1.121 . . . . 0.0 113.74 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.47 ' HG1' ' HG ' ' A' ' 48' ' ' CYS . 74.4 m -65.97 127.64 32.89 Favored 'General case' 0 N--CA 1.481 1.117 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 169.358 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 9.0 m -59.57 123.19 16.07 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 109.611 -0.515 . . . . 0.0 109.611 176.79 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 36.4 mm -59.51 105.7 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.929 0 O-C-N 123.757 0.661 . . . . 0.0 110.725 -176.847 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 35.4 t -79.28 -46.08 23.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 175.474 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 30.0 p -160.24 138.78 10.31 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.171 0.588 . . . . 0.0 111.071 176.896 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.5 HG11 HG21 ' A' ' 35' ' ' ILE . 65.4 t -106.66 108.5 25.31 Favored 'Isoleucine or valine' 0 C--O 1.243 0.722 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 170.564 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -104.12 147.38 27.49 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 123.322 0.649 . . . . 0.0 109.798 178.657 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -69.46 96.8 0.93 Allowed 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 178.043 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 63.4 t90 . . . . . 0 CA--C 1.543 0.701 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 -178.894 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 77.9 p . . . . . 0 N--CA 1.475 0.779 0 CA-C-O 120.685 0.279 . . . . 0.0 110.841 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 8.3 p80 -136.6 99.58 4.11 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 172.255 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 83.5 mtp -123.58 120.85 26.82 Favored Pre-proline 0 N--CA 1.482 1.169 0 C-N-CA 123.263 0.625 . . . . 0.0 109.703 -176.952 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -75.36 -31.37 5.82 Favored 'Trans proline' 0 C--N 1.38 2.233 0 C-N-CA 122.485 2.123 . . . . 0.0 111.691 174.931 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 49.3 p -86.29 103.52 14.97 Favored 'General case' 0 C--O 1.24 0.559 0 C-N-CA 124.127 0.971 . . . . 0.0 109.61 179.72 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.43 ' OG ' ' HB2' ' A' ' 10' ' ' LEU . 37.1 t -101.66 155.02 18.36 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.084 0.954 . . . . 0.0 110.335 -178.506 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -65.53 -34.0 77.24 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.56 0.744 . . . . 0.0 110.957 -178.478 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -137.6 -156.58 0.7 Allowed 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 124.43 1.092 . . . . 0.0 108.18 176.214 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -81.5 43.34 0.73 Allowed 'General case' 0 N--CA 1.484 1.238 0 CA-C-O 121.568 0.699 . . . . 0.0 110.329 171.63 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.675 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 93.8 mt -66.71 125.86 27.16 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.903 -173.539 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.525 ' SG ' ' HB2' ' A' ' 30' ' ' SER . 42.0 t -49.71 111.62 2.16 Favored Pre-proline 0 CA--C 1.547 0.862 0 C-N-CA 124.753 1.221 . . . . 0.0 110.211 179.589 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -62.44 -21.41 72.72 Favored 'Trans proline' 0 C--N 1.378 2.089 0 C-N-CA 123.22 2.614 . . . . 0.0 113.661 -171.771 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 64.9 mt -68.41 -27.54 37.07 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.153 0 C-N-CA 124.064 0.946 . . . . 0.0 111.411 176.573 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 64.6 m -125.75 -32.85 2.8 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 -164.215 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 68.03 -47.02 0.52 Allowed 'General case' 0 N--CA 1.495 1.799 0 C-N-CA 125.807 1.643 . . . . 0.0 114.068 -173.006 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -66.52 -37.76 85.73 Favored 'General case' 0 CA--C 1.55 0.946 0 N-CA-C 113.677 0.991 . . . . 0.0 113.677 -168.635 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 20.8 m-70 -118.77 150.88 49.25 Favored Pre-proline 0 N--CA 1.491 1.6 0 C-N-CA 123.58 0.752 . . . . 0.0 109.85 -176.841 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.675 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 43.9 Cg_endo -84.26 -173.35 1.51 Allowed 'Trans proline' 0 C--N 1.379 2.134 0 C-N-CA 123.042 2.495 . . . . 0.0 113.42 -178.116 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 82.8 mt -80.31 142.54 13.76 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.794 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.349 176.419 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.487 ' HB3' ' HG3' ' A' ' 32' ' ' LYS . 23.1 t -150.17 -4.01 0.36 Allowed 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 123.236 0.614 . . . . 0.0 111.692 177.803 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -137.64 132.4 32.93 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.017 0.527 . . . . 0.0 110.725 -175.104 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 12.9 p -106.05 145.85 13.47 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 C-N-CA 124.621 1.168 . . . . 0.0 109.6 174.029 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 19.7 m-85 -112.59 88.27 2.78 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.694 0.798 . . . . 0.0 109.496 -175.304 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 51.0 mt-30 -75.82 155.83 84.81 Favored Pre-proline 0 C--O 1.243 0.737 0 C-N-CA 124.078 0.951 . . . . 0.0 111.824 -176.531 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -82.32 2.21 50.62 Favored 'Cis proline' 0 N--CA 1.508 2.333 0 N-CA-C 114.585 0.956 . . . . 0.0 114.585 -2.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 41.5 t -64.44 -49.65 70.62 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.303 0.641 . . . . 0.0 112.308 -177.212 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 101.65 -3.1 53.14 Favored Glycine 0 CA--C 1.529 0.955 0 CA-C-O 118.47 -1.183 . . . . 0.0 114.691 178.196 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.604 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 4.4 m170 -62.74 145.04 55.75 Favored 'General case' 0 N--CA 1.492 1.67 0 CA-C-N 118.493 1.146 . . . . 0.0 110.01 175.569 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 50.8 mttp -133.34 147.91 51.85 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 122.738 0.415 . . . . 0.0 111.254 -169.254 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.525 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 88.1 p -161.19 -169.7 2.42 Favored 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 124.105 0.962 . . . . 0.0 108.971 174.045 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 17.7 p -74.42 151.96 39.56 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 122.561 0.345 . . . . 0.0 110.372 177.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.487 ' HG3' ' HB3' ' A' ' 20' ' ' SER . 28.0 mtpp -58.69 -37.77 76.8 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.141 0.576 . . . . 0.0 111.439 179.057 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -58.3 -28.64 65.2 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.51 0.724 . . . . 0.0 112.68 178.707 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.2 m -59.54 -62.15 2.09 Favored 'General case' 0 N--CA 1.483 1.18 0 O-C-N 123.747 0.655 . . . . 0.0 110.89 177.276 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.687 HG12 HG21 ' A' ' 55' ' ' VAL . 7.3 tp -66.76 -41.06 87.38 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 O-C-N 123.8 0.688 . . . . 0.0 111.447 -172.371 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -58.53 -43.65 89.3 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 122.808 0.443 . . . . 0.0 110.816 179.555 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -71.77 -34.84 69.8 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.39 0.676 . . . . 0.0 109.893 176.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 74.9 t60 -70.98 -28.57 64.54 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.288 1.035 . . . . 0.0 111.097 -176.47 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 94.7 mt -70.61 -11.25 60.82 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.426 0.69 . . . . 0.0 111.632 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 30.8 mmt -82.15 -14.27 55.94 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.941 0.896 . . . . 0.0 110.931 172.742 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 -116.09 -74.19 0.62 Allowed 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.699 1.2 . . . . 0.0 109.783 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 79.0 m-20 -125.28 -168.09 1.78 Allowed 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 124.528 1.131 . . . . 0.0 110.9 -176.717 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -134.66 24.59 3.7 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 124.312 1.045 . . . . 0.0 109.512 171.291 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -87.57 165.1 15.71 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-O 121.326 0.584 . . . . 0.0 111.85 -175.572 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.604 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 43.5 t -94.19 36.15 1.15 Allowed 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.813 1.245 . . . . 0.0 112.086 -169.557 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 54.16 -82.39 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 125.429 1.492 . . . . 0.0 113.197 169.052 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 41.6 m-85 -70.71 -11.99 61.28 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.119 1.368 . . . . 0.0 113.071 -169.743 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 15.3 p -143.14 -7.13 0.81 Allowed 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 122.87 0.468 . . . . 0.0 111.638 178.395 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 52.1 tttm 63.03 22.79 13.65 Favored 'General case' 0 CA--C 1.569 1.676 0 C-N-CA 124.496 1.118 . . . . 0.0 113.124 176.292 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 56.0 m -73.13 151.84 41.42 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.216 0.607 . . . . 0.0 110.625 174.173 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 56.6 m -63.43 120.5 11.77 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 122.605 0.362 . . . . 0.0 110.373 174.794 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.48 HG21 HG22 ' A' ' 55' ' ' VAL . 49.5 mt -79.9 111.38 16.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 172.681 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 87.2 t -75.57 -46.04 37.89 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 O-C-N 123.452 0.47 . . . . 0.0 109.75 176.587 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.5 m -141.91 134.4 28.16 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 122.828 0.451 . . . . 0.0 110.677 -179.268 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.687 HG21 HG12 ' A' ' 35' ' ' ILE . 41.6 t -102.3 104.12 16.01 Favored 'Isoleucine or valine' 0 C--O 1.244 0.781 0 C-N-CA 123.776 0.831 . . . . 0.0 108.888 172.865 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 52.8 mm-40 -105.0 156.78 17.72 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 109.843 -0.429 . . . . 0.0 109.843 179.866 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -78.79 108.11 11.99 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.319 175.876 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 53.2 t90 -74.93 112.02 10.73 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 175.346 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -79.29 131.15 36.06 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 174.321 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 16.5 ptpt -95.31 6.33 49.31 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.175 0.59 . . . . 0.0 111.183 178.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.315 0 CA-C-O 118.906 -0.941 . . . . 0.0 112.063 176.884 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 28.6 p . . . . . 0 N--CA 1.479 0.976 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 55.9 t-80 -95.35 126.69 40.83 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.273 0.629 . . . . 0.0 109.937 -179.239 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.403 ' SD ' ' N ' ' A' ' 3' ' ' MET . 0.0 OUTLIER -118.34 91.2 40.42 Favored Pre-proline 0 CA--C 1.561 1.395 0 C-N-CA 123.546 0.738 . . . . 0.0 110.37 179.456 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -70.84 -32.59 13.83 Favored 'Trans proline' 0 C--N 1.381 2.267 0 C-N-CA 122.63 2.22 . . . . 0.0 112.737 178.076 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 41.2 p -107.75 96.57 6.48 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.686 0.795 . . . . 0.0 109.151 174.313 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 19.3 m -91.97 53.42 2.18 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.624 0.77 . . . . 0.0 109.212 178.212 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -82.82 78.54 9.4 Favored 'General case' 0 CA--C 1.544 0.75 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.56 -171.609 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.618 ' HB3' ' HG ' ' A' ' 10' ' ' LEU . 10.2 mm-40 61.33 -178.08 0.12 Allowed 'General case' 0 CA--C 1.558 1.257 0 C-N-CA 125.364 1.465 . . . . 0.0 113.851 163.883 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -116.58 18.77 14.91 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.937 0.895 . . . . 0.0 108.741 172.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.703 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 58.9 mt -84.02 169.64 14.76 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.256 0.622 . . . . 0.0 111.856 -167.477 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 42.6 t -61.33 118.98 42.12 Favored Pre-proline 0 CA--C 1.549 0.936 0 CA-C-N 115.041 -0.981 . . . . 0.0 109.705 177.19 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -71.07 -3.58 13.14 Favored 'Trans proline' 0 C--N 1.379 2.182 0 C-N-CA 123.082 2.521 . . . . 0.0 113.498 -175.407 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 61.1 mt -91.95 -22.69 5.95 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.311 0 C-N-CA 124.367 1.067 . . . . 0.0 110.529 177.376 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 71.2 m -124.75 -51.38 1.71 Allowed 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.257 0.623 . . . . 0.0 112.073 -167.033 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 90.8 m-85 71.69 -8.83 1.02 Allowed 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 125.669 1.588 . . . . 0.0 113.587 179.528 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -100.4 -14.22 18.42 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 118.962 0.801 . . . . 0.0 111.513 179.022 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 85.2 m-70 -138.68 149.45 62.37 Favored Pre-proline 0 N--CA 1.485 1.296 0 C-N-CA 123.403 0.681 . . . . 0.0 109.74 177.731 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.703 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 64.2 Cg_endo -68.95 174.33 8.95 Favored 'Trans proline' 0 C--N 1.383 2.392 0 C-N-CA 123.422 2.748 . . . . 0.0 114.572 -177.429 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 73.2 mt -72.7 127.78 34.98 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 N-CA-C 107.718 -1.215 . . . . 0.0 107.718 167.802 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 51.5 p -142.65 15.27 1.97 Allowed 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.191 0.596 . . . . 0.0 111.531 -174.358 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -154.82 149.34 26.32 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.544 0.738 . . . . 0.0 110.242 -176.821 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.7 p -140.69 126.53 20.23 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 175.607 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -87.16 104.73 16.64 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.905 0.882 . . . . 0.0 109.429 -172.513 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -100.63 142.91 25.53 Favored Pre-proline 0 CA--C 1.556 1.186 0 C-N-CA 123.972 0.909 . . . . 0.0 109.587 -175.009 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.46 ' HD3' ' HB ' ' A' ' 53' ' ' VAL . 85.8 Cg_endo -96.31 89.88 0.12 OUTLIER 'Cis proline' 0 C--N 1.382 2.29 0 CA-C-N 120.073 1.062 . . . . 0.0 112.411 -1.764 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 47.8 t -142.95 -39.84 0.33 Allowed 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 116.095 -0.502 . . . . 0.0 112.056 173.586 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 100.88 -16.28 57.55 Favored Glycine 0 C--N 1.349 1.269 0 CA-C-O 118.96 -0.911 . . . . 0.0 114.339 175.584 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.584 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 11.6 m170 -59.77 134.18 56.79 Favored 'General case' 0 N--CA 1.489 1.507 0 CA-C-N 117.789 0.795 . . . . 0.0 110.266 174.865 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -116.57 160.23 20.96 Favored 'General case' 0 C--O 1.238 0.471 0 C-N-CA 123.814 0.846 . . . . 0.0 111.039 -173.405 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 45.2 t -174.4 -176.19 1.06 Allowed 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.292 1.437 . . . . 0.0 108.57 -177.295 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 16.1 p -89.75 151.4 21.85 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 173.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.1 -25.16 67.97 Favored 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -178.269 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.2 -41.55 88.82 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.489 0.716 . . . . 0.0 111.499 174.491 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.7 m -56.87 -56.6 19.5 Favored 'General case' 0 N--CA 1.477 0.92 0 O-C-N 124.255 0.972 . . . . 0.0 111.109 178.26 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.541 HG12 HG21 ' A' ' 55' ' ' VAL . 8.0 tp -69.41 -38.97 78.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 O-C-N 123.578 0.549 . . . . 0.0 110.8 -171.624 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 86.6 m-20 -62.93 -37.64 87.83 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 122.728 0.411 . . . . 0.0 110.992 176.563 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 63.8 tt0 -70.81 -34.17 71.45 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.187 0.595 . . . . 0.0 110.737 175.422 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 33.0 t60 -70.21 -34.71 73.24 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.743 0.817 . . . . 0.0 109.936 179.123 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 98.1 mt -72.83 -7.53 51.22 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.956 0.902 . . . . 0.0 111.798 -179.3 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 94.1 mmm -79.26 -16.96 55.63 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.47 0.708 . . . . 0.0 110.809 170.299 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 64.9 m-20 -116.9 -73.58 0.64 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.814 0.846 . . . . 0.0 109.644 -179.031 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -125.39 -167.26 1.66 Allowed 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 124.718 1.207 . . . . 0.0 110.328 -175.712 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 89.0 tttt -142.13 81.46 1.75 Allowed 'General case' 0 N--CA 1.476 0.866 0 CA-C-O 121.393 0.616 . . . . 0.0 109.808 178.886 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.45 ' HB3' ' HA ' ' A' ' 49' ' ' LYS . 15.2 m-20 -136.1 166.26 23.8 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-O 121.946 0.879 . . . . 0.0 110.89 -173.735 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.584 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 41.9 t -92.9 29.68 1.76 Allowed 'General case' 0 N--CA 1.48 1.034 0 CA-C-N 113.818 -1.537 . . . . 0.0 110.564 178.894 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 63.4 -85.69 0.02 OUTLIER 'General case' 0 C--N 1.358 0.953 0 C-N-CA 125.197 1.399 . . . . 0.0 112.698 172.585 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 43.8 m-85 -64.2 -51.82 61.88 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.579 1.152 . . . . 0.0 111.014 -166.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 20.2 p -93.19 -11.8 31.85 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.561 -178.351 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.45 ' HA ' ' HB3' ' A' ' 44' ' ' ASP . 0.1 OUTLIER 61.21 27.51 17.24 Favored 'General case' 0 N--CA 1.495 1.797 0 C-N-CA 124.987 1.315 . . . . 0.0 113.26 -176.452 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 85.5 m -65.42 118.91 10.08 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.039 0.535 . . . . 0.0 109.625 169.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 85.3 m -56.1 129.29 39.36 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.313 0.645 . . . . 0.0 110.528 179.218 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.425 HG13 HD11 ' A' ' 35' ' ' ILE . 40.2 mm -63.7 126.09 21.61 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.775 0 C-N-CA 122.971 0.508 . . . . 0.0 111.48 -174.642 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.46 ' HB ' ' HD3' ' A' ' 25' ' ' PRO . 60.9 t -97.67 -42.9 11.9 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 169.434 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.1 t -153.9 151.95 30.05 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.927 0.891 . . . . 0.0 110.255 177.3 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.541 HG21 HG12 ' A' ' 35' ' ' ILE . 43.1 t -124.5 122.44 63.9 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 169.83 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -93.04 150.98 20.15 Favored 'General case' 0 C--O 1.242 0.671 0 C-N-CA 122.881 0.472 . . . . 0.0 110.679 179.682 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -76.02 95.85 3.68 Favored 'General case' 0 C--O 1.242 0.704 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 172.675 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 61.4 t90 -84.92 117.62 24.03 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 -177.823 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -111.41 128.36 55.96 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.268 1.027 . . . . 0.0 109.532 177.7 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 27.6 ttpp -87.2 129.76 34.83 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 174.535 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.955 0 CA-C-O 118.724 -1.042 . . . . 0.0 110.922 -177.104 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 39.1 m . . . . . 0 N--CA 1.477 0.925 0 N-CA-C 110.291 -0.262 . . . . 0.0 110.291 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 45.1 t-80 -66.87 -59.31 3.64 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 123.847 0.859 . . . . 0.0 110.241 172.734 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 24.4 ptp -123.18 143.67 41.53 Favored Pre-proline 0 N--CA 1.476 0.865 0 C-N-CA 123.504 0.722 . . . . 0.0 109.63 178.275 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -81.8 128.43 5.92 Favored 'Trans proline' 0 C--N 1.372 1.782 0 C-N-CA 122.625 2.217 . . . . 0.0 111.446 171.92 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 49.3 p -78.72 152.96 31.26 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 123.244 0.618 . . . . 0.0 109.353 173.156 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.483 ' HB3' ' O ' ' A' ' 16' ' ' ALA . 23.3 t -157.7 118.43 3.49 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 69.46 177.86 0.26 Allowed 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 125.251 1.421 . . . . 0.0 111.509 -172.68 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -129.43 173.46 10.53 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 124.731 1.212 . . . . 0.0 109.443 172.618 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 57.12 55.38 6.04 Favored 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 -160.412 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.589 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 96.9 mt -69.81 142.91 53.06 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 114.192 -1.367 . . . . 0.0 112.162 -171.726 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.549 ' SG ' ' HB2' ' A' ' 30' ' ' SER . 47.5 t -62.58 113.22 8.29 Favored Pre-proline 0 CA--C 1.538 0.486 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 169.889 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -58.73 -20.29 50.43 Favored 'Trans proline' 0 C--N 1.373 1.821 0 C-N-CA 122.921 2.414 . . . . 0.0 113.894 -172.07 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.8 mp -80.93 -49.7 17.89 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.159 0 C-N-CA 123.686 0.795 . . . . 0.0 110.393 176.364 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 95.8 m -79.84 -47.57 14.93 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.23 0.612 . . . . 0.0 112.469 -170.179 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 74.66 -37.96 0.37 Allowed 'General case' 0 N--CA 1.497 1.878 0 C-N-CA 126.076 1.751 . . . . 0.0 113.14 -174.592 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.483 ' O ' ' HB3' ' A' ' 6' ' ' SER . . . -91.2 0.47 57.52 Favored 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 112.914 0.709 . . . . 0.0 112.914 -175.357 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 92.1 m-70 -146.63 151.33 42.58 Favored Pre-proline 0 N--CA 1.49 1.539 0 C-N-CA 123.833 0.853 . . . . 0.0 108.812 177.904 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.589 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 78.7 Cg_endo -77.49 -169.8 0.82 Allowed 'Trans proline' 0 C--N 1.378 2.087 0 C-N-CA 123.528 2.819 . . . . 0.0 114.275 -175.939 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 84.8 mt -85.94 155.12 3.42 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.346 0 C-N-CA 124.685 1.194 . . . . 0.0 110.732 177.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 34.8 t -141.56 -10.96 0.92 Allowed 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 124.049 0.94 . . . . 0.0 111.511 177.478 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -149.94 146.73 27.22 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.094 0.558 . . . . 0.0 111.605 -170.453 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.6 p -111.66 141.03 28.34 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 124.293 1.037 . . . . 0.0 110.22 175.011 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.47 ' HZ ' ' HG ' ' A' ' 30' ' ' SER . 17.7 m-85 -97.72 96.16 8.06 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.647 0.779 . . . . 0.0 108.957 176.971 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 36.3 mt-30 -90.26 148.83 40.06 Favored Pre-proline 0 CA--C 1.543 0.698 0 C-N-CA 123.344 0.658 . . . . 0.0 110.983 -179.273 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -88.18 13.92 50.0 Favored 'Cis proline' 0 C--N 1.38 2.197 0 N-CA-C 114.606 0.964 . . . . 0.0 114.606 4.473 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 52.2 t -67.08 -70.41 0.25 Allowed 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -173.025 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 130.4 -24.2 4.45 Favored Glycine 0 C--N 1.347 1.172 0 CA-C-O 119.487 -0.618 . . . . 0.0 113.052 -177.096 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.565 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 25.6 m170 -61.29 145.77 50.26 Favored 'General case' 0 N--CA 1.486 1.363 0 CA-C-N 117.427 0.613 . . . . 0.0 110.168 171.546 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 60.4 mttp -136.82 161.32 36.32 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.404 0.682 . . . . 0.0 111.001 -171.127 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.549 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 51.3 p -165.41 -174.47 3.19 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.201 1.0 . . . . 0.0 108.99 173.153 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 17.4 p -79.17 156.35 28.25 Favored 'General case' 0 C--O 1.246 0.898 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 173.133 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -64.41 -26.61 68.53 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.302 0.641 . . . . 0.0 112.302 -177.563 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.37 -35.35 77.21 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.063 0.545 . . . . 0.0 111.937 176.581 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 17.6 m -69.28 -43.73 73.3 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.306 0.642 . . . . 0.0 111.564 179.031 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.548 HG12 HG21 ' A' ' 55' ' ' VAL . 9.8 tp -75.96 -31.73 22.43 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 CA-C-O 119.662 -0.209 . . . . 0.0 110.928 -177.806 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 58.6 t30 -61.25 -44.81 96.63 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 174.106 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 42.6 tt0 -58.46 -44.0 89.11 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 124.76 1.224 . . . . 0.0 110.907 173.004 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 49.4 t60 -71.69 -35.22 70.19 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.492 -172.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.436 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 90.6 mt -69.61 -11.91 61.21 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.397 0.679 . . . . 0.0 112.126 -178.267 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 19.3 mmt -78.56 -14.89 59.11 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 123.87 0.868 . . . . 0.0 110.585 173.016 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 21.1 m-80 -115.98 -75.84 0.58 Allowed 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.505 1.122 . . . . 0.0 109.416 -178.213 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 49.4 m-80 -132.22 -170.93 2.52 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 124.319 1.047 . . . . 0.0 110.01 -176.539 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -132.68 29.41 4.18 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 123.379 0.672 . . . . 0.0 110.025 177.598 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.424 ' HA ' ' HA ' ' A' ' 51' ' ' THR . 23.8 m-20 -89.76 161.11 16.21 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.748 0.819 . . . . 0.0 110.992 178.477 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.565 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 40.8 t -91.7 60.43 3.97 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.195 0.598 . . . . 0.0 111.762 -175.58 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 36.0 m-85 47.71 -90.84 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 126.183 1.793 . . . . 0.0 113.922 168.927 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 -73.51 -56.84 4.51 Favored 'General case' 0 C--N 1.354 0.804 0 C-N-CA 123.775 0.83 . . . . 0.0 110.879 -169.411 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 13.1 p -77.83 -20.39 53.24 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.857 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 1.2 tmtp? 69.29 1.46 3.27 Favored 'General case' 0 CA--C 1.564 1.514 0 C-N-CA 125.133 1.373 . . . . 0.0 113.433 176.665 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 29.1 m -56.79 120.98 8.78 Favored 'General case' 0 CA--C 1.551 1.006 0 O-C-N 121.593 -0.692 . . . . 0.0 110.041 175.438 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.424 ' HA ' ' HA ' ' A' ' 44' ' ' ASP . 21.4 m -59.98 129.25 40.87 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.16 0.584 . . . . 0.0 111.053 -174.901 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.526 HG21 HG22 ' A' ' 55' ' ' VAL . 17.1 mt -81.62 127.75 39.31 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 C-N-CA 124.052 0.941 . . . . 0.0 109.552 -175.129 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 78.0 t -74.97 -50.61 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 N-CA-C 109.273 -0.639 . . . . 0.0 109.273 173.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 33.0 t -147.4 134.67 20.6 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.214 -179.3 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.548 HG21 HG12 ' A' ' 35' ' ' ILE . 44.2 t -98.87 103.03 14.19 Favored 'Isoleucine or valine' 0 C--O 1.239 0.526 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 175.073 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -91.91 169.17 10.89 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 177.091 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -82.49 150.28 27.1 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 170.755 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 81.6 t90 -131.55 117.44 18.76 Favored 'General case' 0 C--O 1.243 0.756 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 173.653 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -116.26 124.67 50.77 Favored 'General case' 0 C--O 1.243 0.721 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 170.264 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.18 152.02 17.93 Favored 'General case' 0 CA--C 1.556 1.185 0 C-N-CA 124.518 1.127 . . . . 0.0 111.9 175.656 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.343 0.959 0 CA-C-O 119.077 -0.846 . . . . 0.0 110.998 -178.753 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 31.0 m . . . . . 0 N--CA 1.475 0.776 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 13.5 p80 -84.75 132.74 34.41 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.354 0.662 . . . . 0.0 110.238 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 53.2 ttp -161.37 81.57 1.99 Allowed Pre-proline 0 CA--C 1.548 0.869 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 174.72 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -64.85 85.18 0.17 Allowed 'Trans proline' 0 C--N 1.383 2.355 0 C-N-CA 123.163 2.576 . . . . 0.0 111.757 176.596 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 31.6 m -88.17 84.07 6.93 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.638 -177.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 47.1 t -75.35 94.53 3.06 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 108.382 -0.969 . . . . 0.0 108.382 172.719 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -150.29 179.58 8.0 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.242 -169.895 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -79.87 167.88 19.97 Favored 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 123.654 0.782 . . . . 0.0 111.688 -173.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.401 ' HB3' HD12 ' A' ' 19' ' ' ILE . 9.2 m-20 -66.42 75.39 0.1 Allowed 'General case' 0 C--N 1.359 0.983 0 C-N-CA 124.762 1.225 . . . . 0.0 108.465 165.521 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.675 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 96.6 mt -79.32 152.14 30.64 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 114.204 -1.362 . . . . 0.0 110.471 -179.802 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 35.4 t -61.74 116.34 20.39 Favored Pre-proline 0 CA--C 1.545 0.762 0 O-C-N 124.032 0.832 . . . . 0.0 108.952 172.436 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -64.95 -7.66 15.82 Favored 'Trans proline' 0 C--N 1.373 1.849 0 C-N-CA 123.029 2.486 . . . . 0.0 113.476 -172.966 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.3 mp -90.93 -54.09 7.97 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.151 0 C-N-CA 124.096 0.958 . . . . 0.0 109.436 172.05 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 70.7 m -83.73 -58.63 2.72 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 122.958 0.503 . . . . 0.0 112.333 -171.006 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.428 ' HA ' ' HB3' ' A' ' 10' ' ' LEU . 92.1 m-85 75.3 -36.23 0.3 Allowed 'General case' 0 N--CA 1.494 1.739 0 C-N-CA 126.243 1.817 . . . . 0.0 111.996 -170.734 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.92 -27.84 67.09 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 124.322 1.049 . . . . 0.0 112.452 178.603 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 42.3 m80 -135.48 154.8 78.65 Favored Pre-proline 0 CA--C 1.557 1.214 0 C-N-CA 124.345 1.058 . . . . 0.0 109.977 176.705 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.675 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 84.7 Cg_endo -73.98 -165.08 0.24 Allowed 'Trans proline' 0 C--N 1.378 2.125 0 C-N-CA 123.361 2.707 . . . . 0.0 114.678 -175.631 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.401 HD12 ' HB3' ' A' ' 9' ' ' ASP . 83.4 mt -84.09 150.24 4.17 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.0 0 C-N-CA 124.139 0.976 . . . . 0.0 110.416 175.346 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.413 ' HB2' ' H ' ' A' ' 32' ' ' LYS . 6.9 m -138.99 -26.54 0.84 Allowed 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.752 0.821 . . . . 0.0 111.317 -178.423 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -139.7 140.08 36.74 Favored 'General case' 0 C--O 1.241 0.644 0 C-N-CA 123.608 0.763 . . . . 0.0 110.386 -174.338 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.6 p -102.89 139.93 22.53 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 C-N-CA 123.923 0.889 . . . . 0.0 109.974 175.774 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 10.4 m-85 -88.25 88.28 7.58 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 176.262 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 62.5 tt0 -85.1 139.68 36.78 Favored Pre-proline 0 CA--C 1.553 1.059 0 CA-C-N 115.067 -0.97 . . . . 0.0 110.208 -172.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -95.71 15.16 39.36 Favored 'Cis proline' 0 C--N 1.386 2.519 0 N-CA-C 114.853 1.059 . . . . 0.0 114.853 4.242 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 44.7 t -59.96 -59.74 4.94 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -173.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 123.71 -28.89 5.34 Favored Glycine 0 C--N 1.344 0.998 0 CA-C-O 119.299 -0.723 . . . . 0.0 113.035 -177.49 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.537 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 13.7 m170 -55.26 139.49 42.29 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 171.454 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 57.9 mttp -129.94 170.62 13.71 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 123.294 0.638 . . . . 0.0 110.642 -177.453 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 47.9 t -175.3 177.19 1.9 Allowed 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.846 1.258 . . . . 0.0 108.624 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 14.3 p -77.38 153.57 33.58 Favored 'General case' 0 C--O 1.25 1.13 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 172.695 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.413 ' H ' ' HB2' ' A' ' 20' ' ' SER . 48.4 tttm -65.25 -29.54 70.34 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 123.252 0.621 . . . . 0.0 111.334 -173.893 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -58.54 -43.35 89.23 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.503 0.721 . . . . 0.0 111.49 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 10.9 m -59.27 -51.8 68.42 Favored 'General case' 0 N--CA 1.479 1.021 0 O-C-N 124.029 0.831 . . . . 0.0 111.72 178.457 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.427 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 7.6 tp -73.12 -34.73 45.87 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.779 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.131 -172.92 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -60.7 -43.03 98.29 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 122.523 0.329 . . . . 0.0 110.246 174.106 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 7.3 tp60 -65.72 -34.84 79.14 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.835 175.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 57.9 t60 -69.21 -43.15 74.71 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.615 0.766 . . . . 0.0 110.329 -178.865 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 78.7 mt -66.96 -14.54 62.94 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 124.533 1.133 . . . . 0.0 112.118 -176.735 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 96.2 mmm -64.97 -16.21 63.11 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.591 0.757 . . . . 0.0 111.422 172.732 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -133.92 -68.25 0.57 Allowed 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.728 0.811 . . . . 0.0 110.057 174.454 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 88.1 m-20 -106.13 157.12 17.78 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 124.104 0.961 . . . . 0.0 111.088 -172.093 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.42 ' HD2' ' N ' ' A' ' 43' ' ' LYS . 9.4 mptt -115.68 25.36 10.83 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 123.213 0.605 . . . . 0.0 109.457 179.312 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 50.3 m-20 -91.73 163.15 14.18 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 115.439 -0.8 . . . . 0.0 111.841 -172.678 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.537 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 43.5 t -93.19 50.23 1.5 Allowed 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.805 0.842 . . . . 0.0 111.301 -176.894 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 52.44 -84.03 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 125.561 1.544 . . . . 0.0 114.233 170.834 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 90.9 m-85 -73.8 -62.86 1.35 Allowed 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.126 0.97 . . . . 0.0 110.901 -170.012 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 15.9 p -75.59 -18.97 59.57 Favored 'General case' 0 N--CA 1.48 1.057 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.758 179.291 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt 66.83 13.43 9.4 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 125.073 1.349 . . . . 0.0 113.934 176.778 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 29.8 m -66.78 125.15 24.96 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 176.014 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 49.1 m -60.27 121.96 13.29 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-O 120.974 0.416 . . . . 0.0 110.214 -179.174 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 38.0 mt -72.61 133.26 32.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 C-N-CA 124.517 1.127 . . . . 0.0 109.987 -174.234 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 90.8 t -77.75 -41.97 28.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 O-C-N 123.647 0.592 . . . . 0.0 109.654 177.412 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 77.2 p -152.78 134.54 14.63 Favored 'General case' 0 C--O 1.242 0.699 0 C-N-CA 122.76 0.424 . . . . 0.0 110.754 176.356 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 59.8 t -87.7 104.57 14.51 Favored 'Isoleucine or valine' 0 C--O 1.244 0.796 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 170.23 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -103.0 139.46 38.54 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 -172.304 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -70.85 96.15 1.23 Allowed 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.029 0.932 . . . . 0.0 109.502 -178.533 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 88.2 t90 -82.37 128.62 34.41 Favored 'General case' 0 C--O 1.24 0.595 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.768 -177.818 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -133.77 141.09 47.34 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 177.226 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 62.8 mttm -61.21 -48.52 81.11 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.932 0.893 . . . . 0.0 111.889 -179.828 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.226 0 CA-C-O 119.175 -0.792 . . . . 0.0 112.085 -174.078 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 31.3 t . . . . . 0 N--CA 1.477 0.889 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 87.1 m-70 -93.94 89.34 6.05 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.113 0.565 . . . . 0.0 109.51 179.38 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 21.4 ptt? -149.64 80.09 7.69 Favored Pre-proline 0 CA--C 1.558 1.286 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.11 179.443 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -73.56 121.78 7.36 Favored 'Trans proline' 0 C--N 1.371 1.754 0 C-N-CA 122.264 1.976 . . . . 0.0 110.439 172.532 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 4.6 t -70.98 82.46 0.67 Allowed 'General case' 0 CA--C 1.553 1.068 0 CA-C-O 122.464 1.126 . . . . 0.0 110.321 -178.665 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 43.0 m -79.57 107.86 12.67 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 114.174 -1.375 . . . . 0.0 109.538 -177.1 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -81.55 78.51 8.29 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 123.903 0.881 . . . . 0.0 110.314 -175.736 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.541 ' HB2' ' HG ' ' A' ' 10' ' ' LEU . 37.2 mt-10 -132.19 -173.64 3.21 Favored 'General case' 0 C--O 1.244 0.811 0 C-N-CA 124.78 1.232 . . . . 0.0 108.179 177.83 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -85.36 54.94 3.29 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-O 121.752 0.787 . . . . 0.0 109.208 171.796 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.694 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 96.3 mt -85.43 141.7 29.77 Favored 'General case' 0 C--N 1.349 0.573 0 CA-C-N 115.123 -0.944 . . . . 0.0 109.263 177.326 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 52.1 t -58.61 115.28 11.09 Favored Pre-proline 0 CA--C 1.547 0.841 0 O-C-N 124.234 0.959 . . . . 0.0 109.847 -178.754 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_endo -58.71 -22.22 60.06 Favored 'Trans proline' 0 N--CA 1.502 2.027 0 C-N-CA 123.141 2.561 . . . . 0.0 113.537 -174.38 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 77.3 mt -80.5 -40.03 19.14 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.338 0 C-N-CA 124.115 0.966 . . . . 0.0 111.14 178.313 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 76.5 m -102.72 -54.48 2.64 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 123.616 0.766 . . . . 0.0 111.226 -170.763 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.407 ' O ' HD13 ' A' ' 10' ' ' LEU . 1.7 t80 81.9 -35.87 0.1 Allowed 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 126.616 1.966 . . . . 0.0 111.719 175.36 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.01 -33.63 70.56 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.23 0.612 . . . . 0.0 111.684 179.06 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 41.3 m170 -114.1 150.18 43.18 Favored Pre-proline 0 N--CA 1.483 1.178 0 C-N-CA 123.91 0.884 . . . . 0.0 109.321 179.132 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.694 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 49.4 Cg_endo -79.26 -165.02 0.31 Allowed 'Trans proline' 0 C--N 1.378 2.111 0 C-N-CA 122.924 2.416 . . . . 0.0 113.142 -174.267 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.498 HG21 ' HB3' ' A' ' 29' ' ' LYS . 97.9 mt -86.43 145.09 8.15 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.511 0 C-N-CA 123.946 0.898 . . . . 0.0 109.217 170.889 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.2 m -130.41 -19.99 3.02 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.695 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -137.68 133.77 34.64 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 122.833 0.453 . . . . 0.0 111.91 -168.789 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.7 p -106.57 140.78 23.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 124.833 1.253 . . . . 0.0 109.418 171.638 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -105.47 93.86 4.9 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.07 0.548 . . . . 0.0 110.0 -171.005 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -66.81 144.04 98.36 Favored Pre-proline 0 CA--C 1.547 0.829 0 C-N-CA 123.368 0.667 . . . . 0.0 111.144 175.677 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -85.51 0.25 63.69 Favored 'Cis proline' 0 C--N 1.377 2.035 0 N-CA-C 114.216 0.814 . . . . 0.0 114.216 -1.302 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 51.1 t -64.82 -59.74 3.87 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 -168.174 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 116.73 -16.12 13.99 Favored Glycine 0 C--N 1.346 1.129 0 CA-C-O 119.084 -0.842 . . . . 0.0 114.077 -177.311 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.67 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 9.8 m170 -63.62 161.3 15.05 Favored 'General case' 0 N--CA 1.49 1.558 0 CA-C-N 117.98 0.89 . . . . 0.0 110.515 176.15 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.498 ' HB3' HG21 ' A' ' 19' ' ' ILE . 40.3 mtmt -151.35 144.8 24.85 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 115.401 -0.818 . . . . 0.0 112.615 -161.376 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 59.8 p -156.47 -178.59 7.45 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.324 1.05 . . . . 0.0 109.006 170.545 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 16.8 p -72.05 162.06 30.0 Favored 'General case' 0 C--O 1.247 0.96 0 C-N-CA 122.518 0.327 . . . . 0.0 110.449 178.836 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 32.8 ttmt -55.94 -42.55 76.33 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.316 1.046 . . . . 0.0 110.909 177.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -56.7 -44.89 81.98 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.241 1.016 . . . . 0.0 112.465 -176.257 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 32.3 m -61.72 -54.94 35.81 Favored 'General case' 0 N--CA 1.481 1.105 0 O-C-N 123.776 0.673 . . . . 0.0 110.868 179.197 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 9.0 tp -72.54 -28.02 27.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 C-N-CA 122.796 0.438 . . . . 0.0 111.762 -172.5 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 50.4 t-20 -66.54 -51.78 52.8 Favored 'General case' 0 N--CA 1.486 1.325 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 178.545 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -69.41 -26.38 64.6 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 114.946 -1.025 . . . . 0.0 111.495 177.704 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 48.4 t60 -71.33 -41.34 69.96 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.301 0.64 . . . . 0.0 110.216 178.552 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 92.8 mt -75.08 0.2 16.89 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 123.193 0.597 . . . . 0.0 112.459 -179.006 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 86.3 mtp -80.09 -35.81 36.36 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.478 0.711 . . . . 0.0 109.317 166.917 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -106.28 -73.5 0.68 Allowed 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.136 0.975 . . . . 0.0 110.981 -173.912 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 -103.06 -168.6 1.54 Allowed 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 124.345 1.058 . . . . 0.0 110.703 -175.866 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.408 ' HG3' HG23 ' A' ' 51' ' ' THR . 59.6 pttt -150.55 22.33 0.81 Allowed 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.54 0.736 . . . . 0.0 109.845 176.312 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -97.84 165.39 11.96 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.796 0.838 . . . . 0.0 112.093 -174.062 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.67 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 48.9 t -91.73 39.24 1.0 Allowed 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 124.001 0.921 . . . . 0.0 111.889 -171.636 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 57.05 -84.98 0.02 OUTLIER 'General case' 0 CA--C 1.559 1.314 0 C-N-CA 125.3 1.44 . . . . 0.0 113.156 172.351 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 84.0 m-85 -78.17 -60.41 2.38 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.268 1.027 . . . . 0.0 111.474 -167.275 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 14.2 p -72.13 -21.15 61.51 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-N 117.7 0.227 . . . . 0.0 110.873 178.812 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 8.3 tmtt? 62.01 39.13 13.61 Favored 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 124.803 1.241 . . . . 0.0 111.019 175.284 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 25.2 m -88.63 137.09 32.64 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 166.899 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.408 HG23 ' HG3' ' A' ' 43' ' ' LYS . 29.1 m -68.17 120.66 14.72 Favored 'General case' 0 CA--C 1.554 1.1 0 CA-C-N 118.305 0.502 . . . . 0.0 110.406 -178.706 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 55.4 mt -67.44 131.25 33.05 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 C-N-CA 123.845 0.858 . . . . 0.0 110.115 -179.606 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 93.2 t -87.58 -40.58 13.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 122.855 0.462 . . . . 0.0 110.005 175.195 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.1 t -152.06 140.57 20.67 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 122.742 0.417 . . . . 0.0 110.754 -178.338 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 41.4 t -105.95 128.96 59.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 N-CA-C 108.739 -0.838 . . . . 0.0 108.739 175.819 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.5 mm-40 -118.33 157.31 27.33 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.64 1.176 . . . . 0.0 109.56 178.039 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -81.88 108.7 15.61 Favored 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 174.898 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 61.1 t90 -84.47 107.29 16.64 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 122.89 0.476 . . . . 0.0 109.744 178.29 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -112.41 113.51 25.74 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.351 0.661 . . . . 0.0 109.631 175.705 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 36.7 ttpt -80.05 117.86 21.26 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.412 0.685 . . . . 0.0 109.94 -179.342 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 1.617 0 CA-C-O 118.495 -1.169 . . . . 0.0 112.308 173.692 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 45.2 m . . . . . 0 N--CA 1.486 1.329 0 CA-C-O 120.576 0.227 . . . . 0.0 111.358 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 54.3 t60 -88.26 123.66 33.1 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 123.5 0.72 . . . . 0.0 111.121 -173.012 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 57.4 mtt -73.8 145.02 83.66 Favored Pre-proline 0 CA--C 1.553 1.072 0 C-N-CA 123.909 0.883 . . . . 0.0 110.946 176.433 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -53.87 92.83 0.04 OUTLIER 'Trans proline' 0 C--N 1.391 2.776 0 C-N-CA 123.906 3.071 . . . . 0.0 114.516 -172.624 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 18.7 p -138.29 -42.31 0.51 Allowed 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 125.122 1.369 . . . . 0.0 108.586 172.116 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.596 ' HB3' HD11 ' A' ' 10' ' ' LEU . 63.7 m -72.82 90.46 1.44 Allowed 'General case' 0 C--O 1.24 0.595 0 CA-C-N 115.261 -0.881 . . . . 0.0 108.94 171.913 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.495 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 41.6 mt-10 -62.04 131.36 49.35 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 115.087 -0.96 . . . . 0.0 110.017 -176.507 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -72.99 22.03 0.07 Allowed 'General case' 0 CA--C 1.559 1.302 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 -165.15 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -79.58 -0.3 33.0 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 124.344 1.058 . . . . 0.0 110.883 168.301 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.679 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 41.2 mt -63.32 148.63 47.81 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.106 0.962 . . . . 0.0 112.545 -174.16 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 11.8 t -58.66 108.08 1.19 Allowed Pre-proline 0 CA--C 1.549 0.935 0 CA-C-O 117.903 -1.046 . . . . 0.0 109.413 168.689 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -65.9 -13.16 38.53 Favored 'Trans proline' 0 C--N 1.381 2.265 0 C-N-CA 123.148 2.566 . . . . 0.0 113.237 -171.751 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 55.8 mt -67.71 -23.89 30.16 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.499 0 C-N-CA 124.03 0.932 . . . . 0.0 110.902 173.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 59.4 m -131.03 -55.09 1.05 Allowed 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 124.106 0.963 . . . . 0.0 111.235 -170.015 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 26.0 t80 75.69 28.3 0.93 Allowed 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 126.104 1.762 . . . . 0.0 109.907 178.925 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -104.28 -51.48 3.11 Favored 'General case' 0 CA--C 1.552 1.023 0 CA-C-N 115.469 -0.787 . . . . 0.0 112.246 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 12.2 m-70 -121.93 141.62 34.49 Favored Pre-proline 0 N--CA 1.495 1.806 0 C-N-CA 123.65 0.78 . . . . 0.0 109.948 -173.631 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.679 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 45.8 Cg_endo -84.15 47.26 2.19 Favored 'Trans proline' 0 C--N 1.386 2.539 0 C-N-CA 123.717 2.945 . . . . 0.0 114.796 -171.776 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.465 HG21 ' HB3' ' A' ' 29' ' ' LYS . 77.6 mt 68.21 143.63 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.352 0 C-N-CA 125.164 1.386 . . . . 0.0 112.649 172.273 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.0 t -155.11 19.9 0.43 Allowed 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 122.721 0.408 . . . . 0.0 111.144 176.091 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.474 ' HB2' ' HD2' ' A' ' 32' ' ' LYS . . . -139.97 132.23 28.24 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 122.879 0.472 . . . . 0.0 109.8 176.211 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.4 p -113.24 132.98 60.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 C-N-CA 123.486 0.714 . . . . 0.0 109.236 173.066 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 14.5 m-85 -87.84 90.49 8.4 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 -178.906 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -73.2 136.93 78.77 Favored Pre-proline 0 CA--C 1.553 1.089 0 CA-C-N 114.136 -1.393 . . . . 0.0 109.89 -178.215 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -98.15 20.34 26.46 Favored 'Cis proline' 0 C--N 1.374 1.911 0 N-CA-C 114.595 0.96 . . . . 0.0 114.595 -3.085 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 41.5 t -62.67 -65.6 0.66 Allowed 'General case' 0 N--CA 1.482 1.126 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -175.718 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 128.86 -25.68 4.63 Favored Glycine 0 C--N 1.35 1.347 0 CA-C-O 119.553 -0.582 . . . . 0.0 113.465 -178.001 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.647 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 26.4 m80 -63.06 147.78 49.72 Favored 'General case' 0 N--CA 1.484 1.259 0 CA-C-N 117.212 0.506 . . . . 0.0 109.64 171.077 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.465 ' HB3' HG21 ' A' ' 19' ' ' ILE . 96.1 mttt -133.95 168.92 17.9 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.926 0.89 . . . . 0.0 110.41 -173.567 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 21.2 t -168.81 177.57 4.99 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.604 0.762 . . . . 0.0 110.662 177.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 12.8 p -80.45 153.74 28.05 Favored 'General case' 0 C--O 1.246 0.876 0 CA-C-N 115.573 -0.739 . . . . 0.0 109.217 175.3 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.474 ' HD2' ' HB2' ' A' ' 21' ' ' ALA . 14.9 mmmm -57.96 -39.68 78.73 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.801 0.84 . . . . 0.0 112.366 -172.522 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -64.65 -35.95 82.69 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.783 0.833 . . . . 0.0 112.293 -176.246 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.8 m -59.0 -56.52 21.26 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.05 0.54 . . . . 0.0 111.238 177.895 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 8.4 tp -76.1 -31.32 21.42 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 CA-C-N 115.483 -0.78 . . . . 0.0 111.398 -172.115 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -63.73 -40.22 96.21 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-O 121.0 0.429 . . . . 0.0 110.465 177.138 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -76.12 -35.29 59.34 Favored 'General case' 0 CA--C 1.547 0.851 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.834 176.16 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 84.5 t60 -67.4 -42.97 82.43 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.371 0.668 . . . . 0.0 110.977 -175.277 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 67.9 mt -58.89 -23.88 61.56 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 124.234 1.013 . . . . 0.0 112.573 -177.245 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 55.0 mtt -66.98 -32.42 73.64 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 123.515 0.726 . . . . 0.0 110.756 176.698 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -100.73 -67.9 0.84 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 124.278 1.031 . . . . 0.0 110.559 179.234 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -124.49 156.66 36.88 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 124.019 0.928 . . . . 0.0 111.479 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 32.1 mtmm -102.45 17.47 23.5 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.247 0.619 . . . . 0.0 110.213 176.783 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 42.0 m-20 -88.18 151.74 22.48 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.499 0.72 . . . . 0.0 112.18 -169.151 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.647 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 39.2 t -88.64 58.7 4.78 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.658 0.783 . . . . 0.0 111.408 -177.069 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 42.97 -85.93 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 126.636 1.974 . . . . 0.0 115.094 171.347 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 53.1 m-85 -73.18 -38.23 66.24 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.384 1.074 . . . . 0.0 111.426 -165.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 16.2 p -102.63 -12.65 17.56 Favored 'General case' 0 N--CA 1.483 1.201 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.506 179.355 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.411 ' HE2' ' HB2' ' A' ' 49' ' ' LYS . 1.5 mppt? 54.26 17.74 1.6 Allowed 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 125.759 1.623 . . . . 0.0 113.691 -176.397 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 31.1 m -64.91 116.26 6.2 Favored 'General case' 0 C--N 1.35 0.594 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 174.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 13.1 m -60.13 116.15 3.99 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 122.879 0.472 . . . . 0.0 110.561 -173.86 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.454 HG21 HG22 ' A' ' 55' ' ' VAL . 37.6 mt -66.9 127.43 28.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 C-N-CA 124.733 1.213 . . . . 0.0 110.595 -171.537 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 29.0 t -80.89 -41.72 19.77 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.585 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 47.5 t -146.35 133.48 20.43 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.4 0.68 . . . . 0.0 109.483 177.398 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.454 HG22 HG21 ' A' ' 52' ' ' ILE . 45.9 t -98.54 104.14 15.59 Favored 'Isoleucine or valine' 0 C--O 1.245 0.853 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 172.95 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -91.29 143.66 26.41 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 122.785 0.434 . . . . 0.0 110.251 -178.107 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -76.77 108.44 9.79 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 173.111 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 37.6 t90 -91.83 128.3 37.61 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.79 0.836 . . . . 0.0 110.696 -176.245 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -87.44 122.99 31.89 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 169.631 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 34.4 tttm -85.2 -55.22 4.15 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.347 0.594 . . . . 0.0 110.769 -179.799 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.256 1.511 0 N-CA-C 109.869 -1.292 . . . . 0.0 109.869 -163.736 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 24.0 m . . . . . 0 C--O 1.242 0.669 0 N-CA-C 110.264 -0.272 . . . . 0.0 110.264 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 62.8 m-70 -70.91 87.78 0.73 Allowed 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 169.699 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 56.8 ttp -74.29 113.64 25.66 Favored Pre-proline 0 CA--C 1.549 0.924 0 CA-C-N 115.476 -0.783 . . . . 0.0 110.05 -171.508 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -73.48 -7.49 20.39 Favored 'Trans proline' 0 C--N 1.372 1.805 0 C-N-CA 122.822 2.348 . . . . 0.0 114.319 -172.848 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 75.1 p -68.15 98.51 0.8 Allowed 'General case' 0 CA--C 1.548 0.874 0 CA-C-O 121.073 0.463 . . . . 0.0 110.594 -178.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 27.1 m -75.26 -4.65 40.26 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 123.711 0.805 . . . . 0.0 111.544 178.534 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.572 ' HG3' HD21 ' A' ' 10' ' ' LEU . 10.0 pt-20 -80.02 123.69 28.05 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 123.252 0.621 . . . . 0.0 109.673 171.077 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 26.4 mm-40 -122.3 8.69 9.7 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.035 0.934 . . . . 0.0 111.212 -174.585 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -84.67 26.34 0.82 Allowed 'General case' 0 N--CA 1.493 1.683 0 C-N-CA 123.276 0.63 . . . . 0.0 110.767 173.919 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.572 HD21 ' HG3' ' A' ' 7' ' ' GLU . 35.4 mt -71.81 139.07 48.78 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.316 0.647 . . . . 0.0 111.904 -167.282 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 40.6 t -58.68 115.79 12.99 Favored Pre-proline 0 CA--C 1.549 0.937 0 CA-C-O 117.844 -1.074 . . . . 0.0 108.65 171.366 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_exo -52.56 -30.09 43.39 Favored 'Trans proline' 0 N--CA 1.506 2.212 0 C-N-CA 123.12 2.546 . . . . 0.0 114.066 -171.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.404 HD12 ' H ' ' A' ' 13' ' ' ILE . 4.2 mp -77.04 -37.72 26.86 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.072 0 C-N-CA 124.109 0.964 . . . . 0.0 110.973 -177.339 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 73.9 m -106.07 -47.34 3.86 Favored 'General case' 0 N--CA 1.485 1.28 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 -167.553 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.414 ' HA ' ' HB3' ' A' ' 10' ' ' LEU . 53.4 m-85 77.78 -51.89 0.52 Allowed 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 126.637 1.975 . . . . 0.0 111.638 -174.898 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.13 -5.68 14.49 Favored 'General case' 0 N--CA 1.484 1.265 0 N-CA-C 114.374 1.25 . . . . 0.0 114.374 -170.35 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 28.1 m170 -135.58 132.88 19.91 Favored Pre-proline 0 N--CA 1.483 1.218 0 C-N-CA 123.412 0.685 . . . . 0.0 109.384 172.635 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.561 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 42.2 Cg_endo -86.2 71.31 4.18 Favored 'Trans proline' 0 C--N 1.377 2.054 0 C-N-CA 123.46 2.773 . . . . 0.0 114.386 -173.527 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 81.9 mt 61.88 170.42 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.499 2.024 0 C-N-CA 124.27 1.028 . . . . 0.0 111.017 176.392 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 70.3 m -156.31 -37.91 0.08 Allowed 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 124.074 0.95 . . . . 0.0 110.188 173.337 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.413 ' HA ' ' H ' ' A' ' 58' ' ' TRP . . . -127.28 171.51 11.41 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.093 0.957 . . . . 0.0 111.24 -174.309 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 4.8 p -141.56 140.11 31.39 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 C-N-CA 124.305 1.042 . . . . 0.0 109.443 -179.604 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -88.3 96.4 10.56 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 124.202 1.001 . . . . 0.0 108.878 -178.427 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.7 tp60 -92.75 145.92 31.22 Favored Pre-proline 0 CA--C 1.555 1.137 0 CA-C-N 114.802 -1.09 . . . . 0.0 109.658 -174.563 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -93.59 37.53 5.92 Favored 'Cis proline' 0 C--N 1.378 2.091 0 CA-C-N 120.035 1.048 . . . . 0.0 114.431 -2.384 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 19.3 t -75.66 -78.64 0.11 Allowed 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 122.539 0.336 . . . . 0.0 111.399 176.021 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 141.44 -26.5 2.42 Favored Glycine 0 C--N 1.357 1.702 0 CA-C-O 119.724 -0.487 . . . . 0.0 113.198 -173.615 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.433 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 16.5 m80 -59.57 136.57 58.03 Favored 'General case' 0 N--CA 1.487 1.391 0 CA-C-N 117.144 0.472 . . . . 0.0 110.456 173.748 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -122.74 154.19 38.47 Favored 'General case' 0 C--O 1.238 0.447 0 C-N-CA 123.682 0.793 . . . . 0.0 110.445 -176.054 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 27.0 t -164.28 -168.91 1.66 Allowed 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.655 1.182 . . . . 0.0 107.842 -179.175 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 20.8 p -101.82 164.97 11.45 Favored 'General case' 0 N--CA 1.477 0.92 0 O-C-N 121.619 -0.676 . . . . 0.0 110.979 -179.465 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt -55.12 -42.84 73.47 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 124.576 1.151 . . . . 0.0 110.986 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.89 -44.84 94.01 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.743 0.817 . . . . 0.0 112.266 -177.282 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 7.0 m -58.57 -53.56 56.98 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 123.67 0.788 . . . . 0.0 112.195 -179.22 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 5.6 tp -70.75 -39.39 75.57 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.096 -174.22 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -61.95 -35.88 79.76 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.32 0.648 . . . . 0.0 110.858 177.488 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -73.67 -40.41 63.71 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 124.054 0.942 . . . . 0.0 110.935 176.343 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 77.2 t60 -66.61 -38.77 87.65 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.3 1.04 . . . . 0.0 111.799 -176.365 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 78.5 mt -62.79 -17.14 60.66 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.83 0.852 . . . . 0.0 112.91 -175.798 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 83.0 mtp -67.4 -31.25 71.33 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.432 0.693 . . . . 0.0 111.35 174.616 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 43.2 t-20 -104.38 -68.58 0.84 Allowed 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.7 m-80 -120.89 169.54 10.35 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 123.359 0.664 . . . . 0.0 111.119 -175.296 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 58.6 mmtt -111.25 10.75 21.74 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.396 0.678 . . . . 0.0 109.887 179.152 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 61.3 m-20 -85.5 163.88 18.16 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.726 0.811 . . . . 0.0 113.179 -168.766 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.433 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 42.0 t -92.75 61.14 3.55 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.467 0.707 . . . . 0.0 111.559 -176.698 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 47.37 -81.48 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 125.869 1.668 . . . . 0.0 114.298 164.828 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 47.7 m-85 -79.05 -46.61 17.77 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.368 1.067 . . . . 0.0 111.057 -170.708 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 15.5 p -100.18 -7.02 25.25 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 122.596 0.358 . . . . 0.0 111.498 -177.123 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 58.73 21.82 9.32 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 124.845 1.258 . . . . 0.0 113.623 176.149 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 29.5 m -72.91 124.77 26.1 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 174.35 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 28.5 m -60.23 115.8 3.77 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-O 120.907 0.384 . . . . 0.0 110.038 -178.458 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.463 HG21 HG22 ' A' ' 55' ' ' VAL . 38.7 mt -71.51 125.62 30.34 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 124.126 0.97 . . . . 0.0 110.624 -171.554 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 36.7 t -85.88 -41.47 15.32 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.774 0 C-N-CA 123.227 0.611 . . . . 0.0 109.678 -178.849 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 48.0 m -147.97 145.44 28.55 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.501 0.721 . . . . 0.0 110.024 178.194 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.463 HG22 HG21 ' A' ' 52' ' ' ILE . 38.3 t -115.11 104.62 17.15 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 175.4 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -88.64 144.48 26.26 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 110.065 -0.346 . . . . 0.0 110.065 179.901 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -73.8 103.74 4.45 Favored 'General case' 0 C--O 1.238 0.463 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 172.833 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.413 ' H ' ' HA ' ' A' ' 21' ' ' ALA . 53.5 t90 -72.63 94.84 1.77 Allowed 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 178.512 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -84.61 117.23 23.62 Favored 'General case' 0 C--O 1.237 0.442 0 N-CA-C 107.779 -1.193 . . . . 0.0 107.779 173.076 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 10.0 ptpp? -70.85 -17.77 62.72 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.163 0.585 . . . . 0.0 112.376 -172.022 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.954 0 CA-C-O 119.282 -0.732 . . . . 0.0 111.323 177.261 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 36.1 t . . . . . 0 N--CA 1.475 0.781 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 31.1 p80 -89.51 0.53 56.82 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.548 0.739 . . . . 0.0 111.385 177.801 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 20.3 ptp -113.9 93.42 29.31 Favored Pre-proline 0 CA--C 1.555 1.158 0 C-N-CA 123.48 0.712 . . . . 0.0 111.77 -171.191 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -88.96 -176.05 1.31 Allowed 'Trans proline' 0 C--N 1.377 2.074 0 C-N-CA 122.797 2.332 . . . . 0.0 111.46 169.398 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 6.6 t -147.84 -44.08 0.16 Allowed 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.0 0.52 . . . . 0.0 110.131 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 15.6 m -102.43 80.37 1.93 Allowed 'General case' 0 C--O 1.239 0.513 0 C-N-CA 123.826 0.85 . . . . 0.0 109.433 -178.888 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -70.82 94.08 1.02 Allowed 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.691 179.068 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.559 ' H ' ' HG ' ' A' ' 10' ' ' LEU . 40.2 tt0 -118.43 70.98 0.82 Allowed 'General case' 0 C--O 1.244 0.792 0 C-N-CA 123.899 0.88 . . . . 0.0 109.092 -177.859 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.462 ' O ' HG13 ' A' ' 19' ' ' ILE . 4.5 m-20 54.62 32.34 16.91 Favored 'General case' 0 N--CA 1.482 1.148 0 CA-C-N 114.714 -1.13 . . . . 0.0 111.685 -173.778 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.559 ' HG ' ' H ' ' A' ' 8' ' ' GLU . 48.2 mt -63.87 127.0 29.45 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 122.778 0.431 . . . . 0.0 111.159 -174.768 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 46.4 t -53.07 109.29 1.39 Allowed Pre-proline 0 C--N 1.352 0.685 0 O-C-N 124.375 1.047 . . . . 0.0 109.51 172.701 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -56.39 -31.05 83.94 Favored 'Trans proline' 0 C--N 1.373 1.832 0 C-N-CA 122.905 2.403 . . . . 0.0 113.376 -172.689 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 55.6 mt -66.56 -39.01 82.86 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.004 0 C-N-CA 124.262 1.025 . . . . 0.0 111.5 -179.383 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 82.5 m -106.87 -24.87 11.91 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.415 0.686 . . . . 0.0 112.68 -170.767 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 90.8 m-85 67.27 -60.44 0.37 Allowed 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 126.098 1.759 . . . . 0.0 112.86 -170.86 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.34 -44.13 92.69 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 114.791 1.404 . . . . 0.0 114.791 -165.241 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 54.4 m170 -104.37 150.84 38.88 Favored Pre-proline 0 N--CA 1.485 1.295 0 C-N-CA 123.179 0.591 . . . . 0.0 109.68 -175.571 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.535 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 84.0 Cg_endo -75.39 -164.42 0.24 Allowed 'Trans proline' 0 C--N 1.373 1.864 0 C-N-CA 123.049 2.5 . . . . 0.0 113.685 -179.063 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.462 HG13 ' O ' ' A' ' 9' ' ' ASP . 97.4 mt -78.91 131.59 34.05 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.638 173.776 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 38.7 t -128.13 -5.84 5.5 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.188 0.995 . . . . 0.0 110.497 179.156 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -150.68 158.24 43.92 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.273 0.629 . . . . 0.0 111.309 -176.115 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.1 p -137.64 122.91 24.85 Favored 'Isoleucine or valine' 0 C--O 1.245 0.828 0 C-N-CA 124.293 1.037 . . . . 0.0 109.016 178.122 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.0 m-30 -75.23 86.09 2.44 Favored 'General case' 0 C--O 1.241 0.606 0 CA-C-N 115.167 -0.924 . . . . 0.0 108.674 178.682 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 11.4 mt-30 -87.83 146.47 38.96 Favored Pre-proline 0 CA--C 1.543 0.711 0 C-N-CA 122.87 0.468 . . . . 0.0 111.203 -174.513 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_endo -92.17 17.99 40.68 Favored 'Cis proline' 0 C--N 1.371 1.734 0 C-N-CA 124.859 -0.892 . . . . 0.0 114.094 3.151 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 27.4 t -72.29 -27.5 62.5 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 111.879 0.326 . . . . 0.0 111.879 -173.813 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 90.74 -16.85 57.21 Favored Glycine 0 C--N 1.347 1.179 0 CA-C-O 119.357 -0.69 . . . . 0.0 114.458 175.246 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 5.9 m80 -61.94 120.06 10.05 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.15 0.58 . . . . 0.0 110.26 175.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 52.5 mttp -110.13 159.47 17.32 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.563 0.697 . . . . 0.0 111.763 -174.428 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 93.0 p -166.37 -164.57 0.68 Allowed 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 114.183 -1.371 . . . . 0.0 107.894 173.266 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 16.3 p -86.24 154.17 21.47 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 171.015 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -67.55 -28.81 68.11 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.214 0.606 . . . . 0.0 110.239 -175.38 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -56.95 -41.54 78.45 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.766 0.826 . . . . 0.0 112.012 175.897 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.8 m -55.23 -59.26 5.03 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.511 0.724 . . . . 0.0 110.994 177.419 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.712 HG21 HG11 ' A' ' 55' ' ' VAL . 10.4 tp -73.79 -22.55 18.67 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.763 0 CA-C-N 115.3 -0.863 . . . . 0.0 111.599 -173.263 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -64.49 -42.26 95.97 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 122.802 0.441 . . . . 0.0 109.853 178.121 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 22.7 tm0? -74.69 -34.71 62.71 Favored 'General case' 0 CA--C 1.552 1.048 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.41 176.694 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.502 ' HB3' HD12 ' A' ' 35' ' ' ILE . 41.5 t60 -67.21 -39.93 86.36 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.829 0.852 . . . . 0.0 111.333 -177.69 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 72.7 mt -73.99 -0.89 17.66 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 123.7 0.8 . . . . 0.0 112.82 -177.333 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 64.1 mtt -72.85 -14.31 61.47 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 123.074 0.55 . . . . 0.0 111.245 174.007 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -149.41 -57.58 0.2 Allowed 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.633 0.773 . . . . 0.0 109.621 174.502 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 36.4 m-20 -79.68 172.59 13.58 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.914 0.886 . . . . 0.0 110.71 -175.086 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -159.69 54.18 0.37 Allowed 'General case' 0 N--CA 1.484 1.227 0 CA-C-O 122.073 0.94 . . . . 0.0 109.204 -176.379 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -155.14 174.27 15.43 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.21 -172.031 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 96.9 m -70.6 137.17 49.76 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.87 172.36 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 71.0 m-85 -58.43 -36.12 73.15 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-O 121.198 0.523 . . . . 0.0 109.854 167.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -76.91 -75.23 0.21 Allowed 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 124.625 1.17 . . . . 0.0 111.705 -172.585 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 7.2 p -91.98 -8.25 46.66 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.136 0.575 . . . . 0.0 112.368 -170.141 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 66.56 18.3 10.76 Favored 'General case' 0 CA--C 1.572 1.803 0 C-N-CA 124.287 1.035 . . . . 0.0 111.786 178.578 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 93.6 m -78.59 129.96 35.38 Favored 'General case' 0 N--CA 1.485 1.304 0 O-C-N 121.479 -0.763 . . . . 0.0 110.593 174.742 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 31.2 m -59.97 134.44 57.04 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.249 1.02 . . . . 0.0 111.123 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.505 HG21 HG22 ' A' ' 55' ' ' VAL . 22.0 mt -93.24 135.49 27.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 123.355 0.662 . . . . 0.0 109.94 -177.622 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 77.2 t -79.66 -46.37 22.75 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 C-N-CA 123.106 0.562 . . . . 0.0 109.549 174.223 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 47.1 p -160.33 134.71 7.42 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.035 0.534 . . . . 0.0 110.057 179.612 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.712 HG11 HG21 ' A' ' 35' ' ' ILE . 36.9 t -98.21 105.16 16.88 Favored 'Isoleucine or valine' 0 C--O 1.243 0.762 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 177.807 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -86.06 143.09 28.27 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 176.878 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -71.3 123.94 23.4 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 172.39 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 32.4 t90 -71.75 108.34 5.02 Favored 'General case' 0 C--O 1.242 0.698 0 CA-C-O 121.081 0.467 . . . . 0.0 111.102 -171.753 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -76.85 152.41 35.48 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.475 170.227 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 11.9 mptt -98.51 -16.22 19.26 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.126 0.571 . . . . 0.0 111.022 -174.635 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.35 0 CA-C-O 118.85 -0.972 . . . . 0.0 113.276 177.577 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 42.4 m . . . . . 0 N--CA 1.491 1.603 0 N-CA-C 110.602 -0.147 . . . . 0.0 110.602 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 13.4 t60 -72.97 86.1 1.29 Allowed 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 176.778 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 19.7 ptp -159.79 105.31 1.44 Allowed Pre-proline 0 CA--C 1.548 0.89 0 C-N-CA 124.22 1.008 . . . . 0.0 108.999 178.886 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -62.79 101.31 0.26 Allowed 'Trans proline' 0 C--N 1.378 2.118 0 C-N-CA 122.631 2.22 . . . . 0.0 111.479 174.455 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 5.7 t -163.83 -30.74 0.04 OUTLIER 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 124.075 0.95 . . . . 0.0 110.487 177.527 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 40.3 m 66.62 93.2 0.07 Allowed 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 124.541 1.136 . . . . 0.0 111.435 175.753 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -81.56 152.5 27.21 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.604 0.762 . . . . 0.0 110.666 179.278 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -99.65 56.2 0.98 Allowed 'General case' 0 N--CA 1.484 1.263 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 171.386 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 33.8 t70 58.64 57.82 3.58 Favored 'General case' 0 N--CA 1.479 1.011 0 CA-C-O 122.673 1.225 . . . . 0.0 110.458 -175.017 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.469 HD13 ' O ' ' A' ' 15' ' ' TYR . 75.2 mt -79.79 162.24 25.22 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 114.488 -1.233 . . . . 0.0 109.612 174.8 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 52.4 t -55.04 120.75 31.54 Favored Pre-proline 0 CA--C 1.555 1.155 0 CA-C-O 118.71 -0.662 . . . . 0.0 111.241 -177.263 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -58.1 -27.76 81.09 Favored 'Trans proline' 0 C--N 1.387 2.569 0 C-N-CA 123.236 2.624 . . . . 0.0 113.248 -172.785 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.5 mp -77.49 -47.15 26.76 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.939 0 CA-C-N 114.642 -1.163 . . . . 0.0 110.331 179.09 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 74.3 m -95.61 -59.15 1.93 Allowed 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.354 0.661 . . . . 0.0 111.85 -166.209 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.469 ' O ' HD13 ' A' ' 10' ' ' LEU . 22.6 m-85 75.19 -39.37 0.4 Allowed 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 125.72 1.608 . . . . 0.0 113.09 -172.865 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.57 -8.43 53.98 Favored 'General case' 0 N--CA 1.486 1.341 0 CA-C-N 118.812 0.733 . . . . 0.0 112.339 -179.213 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 70.0 m80 -142.09 153.54 63.69 Favored Pre-proline 0 CA--C 1.555 1.161 0 C-N-CA 124.003 0.921 . . . . 0.0 108.639 175.583 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -79.09 -159.63 0.11 Allowed 'Trans proline' 0 C--N 1.382 2.335 0 C-N-CA 123.289 2.659 . . . . 0.0 113.421 -177.112 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.441 HG21 ' HB3' ' A' ' 29' ' ' LYS . 53.7 mt -98.87 133.52 41.15 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 C-N-CA 124.188 0.995 . . . . 0.0 110.095 176.415 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.406 ' H ' ' HA ' ' A' ' 31' ' ' CYS . 50.1 m -137.4 18.0 2.93 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.196 0.998 . . . . 0.0 110.593 -179.491 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.421 ' HA ' ' O ' ' A' ' 56' ' ' GLU . . . -154.09 141.03 19.25 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.182 0.593 . . . . 0.0 110.747 -176.359 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 6.9 p -123.51 133.21 69.81 Favored 'Isoleucine or valine' 0 C--O 1.241 0.607 0 C-N-CA 123.522 0.729 . . . . 0.0 109.208 173.626 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -86.96 91.24 8.62 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-N 115.182 -0.917 . . . . 0.0 108.606 -179.728 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -83.07 141.99 43.93 Favored Pre-proline 0 CA--C 1.552 1.023 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.389 -171.36 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_endo -97.49 23.62 23.46 Favored 'Cis proline' 0 C--N 1.377 2.031 0 CA-C-N 119.369 0.81 . . . . 0.0 113.2 -1.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 43.0 t -63.34 -55.4 24.86 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.313 0.645 . . . . 0.0 111.757 -176.101 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 117.09 -25.31 8.87 Favored Glycine 0 C--N 1.345 1.074 0 CA-C-O 119.351 -0.694 . . . . 0.0 113.681 -179.356 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.436 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 19.9 m170 -58.64 141.53 52.16 Favored 'General case' 0 N--CA 1.484 1.256 0 CA-C-N 117.43 0.615 . . . . 0.0 109.566 172.087 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.441 ' HB3' HG21 ' A' ' 19' ' ' ILE . 53.9 mttp -132.63 165.09 25.23 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.004 0.522 . . . . 0.0 110.747 -174.389 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 42.9 t -172.18 -179.87 2.43 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.258 1.423 . . . . 0.0 107.909 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.406 ' HA ' ' H ' ' A' ' 20' ' ' SER . 13.9 p -78.24 150.13 33.5 Favored 'General case' 0 C--O 1.245 0.848 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 171.912 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -60.6 -38.12 83.63 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 122.922 0.489 . . . . 0.0 111.827 -175.66 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.41 -32.05 69.82 Favored 'General case' 0 CA--C 1.554 1.133 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -176.563 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.1 m -61.33 -58.43 8.28 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 123.454 0.702 . . . . 0.0 111.139 172.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.552 HG21 HG11 ' A' ' 55' ' ' VAL . 7.0 tp -69.37 -30.4 45.62 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 O-C-N 123.285 0.366 . . . . 0.0 111.295 -173.009 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 61.0 t30 -63.38 -45.7 89.9 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 175.831 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -65.79 -33.57 76.16 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.853 0.861 . . . . 0.0 110.509 175.018 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 69.9 t60 -71.42 -32.78 68.78 Favored 'General case' 0 C--O 1.217 -0.644 0 C-N-CA 123.584 0.753 . . . . 0.0 110.372 -179.342 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.519 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 90.9 mt -66.61 -9.57 36.84 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 123.629 0.772 . . . . 0.0 111.913 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 82.2 mtp -76.69 -41.74 44.24 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 122.979 0.512 . . . . 0.0 109.732 168.725 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -76.09 -70.41 0.44 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.039 0.935 . . . . 0.0 110.294 179.412 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 -143.87 167.39 22.44 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 125.121 1.368 . . . . 0.0 109.271 -177.242 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -98.33 21.2 11.35 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-O 121.813 0.816 . . . . 0.0 110.31 175.364 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -90.37 166.26 13.39 Favored 'General case' 0 CA--C 1.545 0.75 0 CA-C-O 121.811 0.815 . . . . 0.0 112.778 -173.066 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.436 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 43.6 t -96.02 54.35 1.46 Allowed 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 115.287 -0.87 . . . . 0.0 111.245 -171.662 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 49.68 -84.61 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 125.777 1.631 . . . . 0.0 113.649 174.602 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 40.3 m-85 -74.73 -65.4 0.87 Allowed 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.605 1.162 . . . . 0.0 109.937 -169.266 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 14.0 p -75.07 -17.08 60.53 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 122.535 0.334 . . . . 0.0 111.215 -177.847 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 52.1 mttp 65.34 23.56 12.07 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 125.299 1.44 . . . . 0.0 113.372 176.329 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 36.2 m -69.09 128.31 36.2 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 122.563 0.345 . . . . 0.0 110.173 174.337 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 18.0 m -62.27 110.68 1.71 Allowed 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 176.303 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 42.0 mt -70.98 135.14 28.68 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 124.131 0.972 . . . . 0.0 110.977 -172.604 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 60.1 t -78.19 -51.76 17.08 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 C-N-CA 122.97 0.508 . . . . 0.0 109.701 177.84 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 50.3 m -149.91 151.51 33.53 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 -179.127 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.552 HG11 HG21 ' A' ' 35' ' ' ILE . 47.6 t -121.23 110.21 27.31 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.11 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 177.674 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.421 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 1.6 mp0 -92.91 154.59 18.11 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 122.909 0.484 . . . . 0.0 110.785 179.517 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -67.63 96.6 0.55 Allowed 'General case' 0 C--O 1.241 0.631 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 168.809 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 52.9 t90 -75.79 91.65 2.97 Favored 'General case' 0 C--O 1.238 0.454 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 176.581 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -95.05 112.23 23.96 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 114.575 -1.193 . . . . 0.0 109.167 177.305 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 63.1 pttt -76.65 -18.75 58.4 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.997 0.919 . . . . 0.0 110.524 176.688 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.153 0 CA-C-O 118.759 -1.023 . . . . 0.0 111.343 -179.577 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 38.6 t . . . . . 0 N--CA 1.48 1.026 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 75.5 t60 -167.4 93.87 0.43 Allowed 'General case' 0 C--N 1.356 0.864 0 C-N-CA 123.259 0.623 . . . . 0.0 109.42 -179.134 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 61.2 mtt 59.33 92.6 0.06 OUTLIER Pre-proline 0 N--CA 1.486 1.351 0 C-N-CA 124.692 1.197 . . . . 0.0 111.199 178.53 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -73.42 88.25 1.02 Allowed 'Trans proline' 0 C--N 1.379 2.137 0 C-N-CA 122.853 2.369 . . . . 0.0 111.371 -171.282 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 6.3 t 47.12 25.58 0.54 Allowed 'General case' 0 N--CA 1.495 1.821 0 C-N-CA 126.087 1.755 . . . . 0.0 113.032 -178.567 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 25.7 p -69.76 148.44 49.16 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.843 0.857 . . . . 0.0 111.868 -170.749 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -73.6 147.62 43.68 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.52 179.765 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -79.51 -1.36 37.27 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.206 0.602 . . . . 0.0 111.096 175.656 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -77.86 19.68 0.39 Allowed 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 124.773 1.229 . . . . 0.0 111.84 178.624 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.665 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 79.4 mt -60.13 140.47 56.89 Favored 'General case' 0 C--N 1.349 0.575 0 C-N-CA 123.803 0.841 . . . . 0.0 111.497 178.289 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 46.0 t -59.82 119.15 38.4 Favored Pre-proline 0 CA--C 1.545 0.781 0 CA-C-O 118.208 -0.901 . . . . 0.0 108.773 172.122 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -59.81 -28.17 86.61 Favored 'Trans proline' 0 C--N 1.374 1.92 0 C-N-CA 122.586 2.191 . . . . 0.0 112.39 -175.618 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 69.6 mt -72.05 -32.61 44.36 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.099 0 C-N-CA 124.758 1.223 . . . . 0.0 112.201 -179.675 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 79.0 m -118.37 -50.61 2.44 Favored 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -167.091 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 80.39 -42.42 0.22 Allowed 'General case' 0 N--CA 1.498 1.946 0 C-N-CA 126.594 1.958 . . . . 0.0 112.445 -179.109 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.95 -33.32 71.76 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.444 0.698 . . . . 0.0 112.606 -176.343 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 11.6 m170 -125.14 155.33 71.2 Favored Pre-proline 0 N--CA 1.485 1.289 0 C-N-CA 124.099 0.96 . . . . 0.0 109.196 -179.641 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.665 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 95.0 Cg_endo -75.64 -163.51 0.2 Allowed 'Trans proline' 0 C--N 1.38 2.224 0 C-N-CA 122.914 2.41 . . . . 0.0 113.401 -176.332 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 86.8 mt -89.11 142.72 12.48 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 C-N-CA 123.833 0.853 . . . . 0.0 108.869 171.275 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.436 ' HB3' ' H ' ' A' ' 32' ' ' LYS . 39.7 t -129.2 -16.73 3.95 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.479 0.712 . . . . 0.0 110.785 178.687 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -145.58 133.02 20.72 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -168.853 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.6 p -102.5 143.07 15.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 124.892 1.277 . . . . 0.0 109.542 169.409 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 18.5 m-85 -99.13 85.62 3.27 Favored 'General case' 0 C--O 1.242 0.674 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 176.532 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 63.1 tt0 -82.77 143.44 46.73 Favored Pre-proline 0 CA--C 1.553 1.088 0 CA-C-N 114.157 -1.383 . . . . 0.0 108.944 -174.096 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -92.41 13.64 50.37 Favored 'Cis proline' 0 C--N 1.386 2.524 0 N-CA-C 115.925 1.471 . . . . 0.0 115.925 1.846 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 50.8 t -62.03 -53.78 50.8 Favored 'General case' 0 N--CA 1.484 1.251 0 CA-C-N 118.55 0.614 . . . . 0.0 111.798 -177.546 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 129.43 -43.05 1.35 Allowed Glycine 0 C--N 1.347 1.176 0 CA-C-O 119.15 -0.806 . . . . 0.0 113.297 177.422 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.654 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 34.5 m80 -52.16 136.01 30.79 Favored 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 123.426 0.69 . . . . 0.0 112.572 -177.361 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 6.2 mptt -118.49 168.88 10.26 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.514 0.726 . . . . 0.0 110.997 178.225 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 96.9 p -170.2 -176.07 2.14 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.068 1.347 . . . . 0.0 107.738 171.057 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 17.8 p -72.63 146.69 46.43 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 168.683 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.436 ' H ' ' HB3' ' A' ' 20' ' ' SER . 35.2 ttpt -70.31 -16.87 63.05 Favored 'General case' 0 N--CA 1.483 1.213 0 CA-C-O 121.079 0.466 . . . . 0.0 110.882 -175.221 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.91 -39.94 91.23 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 123.646 0.779 . . . . 0.0 111.299 170.171 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.5 m -56.42 -52.42 64.72 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.761 0.824 . . . . 0.0 111.297 178.088 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.437 HD11 HG13 ' A' ' 52' ' ' ILE . 9.7 tp -71.36 -32.78 47.89 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 O-C-N 123.398 0.436 . . . . 0.0 111.04 -174.753 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -59.13 -47.96 83.36 Favored 'General case' 0 N--CA 1.484 1.242 0 CA-C-O 121.104 0.478 . . . . 0.0 110.237 173.833 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -73.3 -21.61 60.54 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 115.035 -0.984 . . . . 0.0 111.699 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 46.7 t60 -77.66 -37.43 49.87 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.557 0.743 . . . . 0.0 110.163 177.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 96.1 mt -73.77 0.73 12.19 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 124.025 0.93 . . . . 0.0 111.648 179.619 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 23.5 mmt -78.8 -14.94 58.98 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 124.134 0.973 . . . . 0.0 110.408 169.766 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -134.83 -70.42 0.5 Allowed 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 123.855 0.862 . . . . 0.0 109.854 179.185 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -102.25 -174.83 2.67 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 124.064 0.946 . . . . 0.0 111.873 -174.058 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -144.93 64.82 1.28 Allowed 'General case' 0 C--N 1.349 0.587 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 175.501 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.472 ' HB3' ' HA ' ' A' ' 49' ' ' LYS . 18.5 m-20 -137.65 159.93 40.6 Favored 'General case' 0 N--CA 1.483 1.202 0 CA-C-O 121.736 0.779 . . . . 0.0 111.295 -169.436 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.654 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 21.8 t -94.51 37.0 1.13 Allowed 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 124.891 1.276 . . . . 0.0 111.194 -172.951 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 58.65 -86.32 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 125.04 1.336 . . . . 0.0 113.65 169.603 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 -87.66 44.71 1.21 Allowed 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 124.871 1.268 . . . . 0.0 112.664 -167.044 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 23.5 p 175.8 -31.96 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 126.093 1.757 . . . . 0.0 107.885 -178.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.472 ' HA ' ' HB3' ' A' ' 44' ' ' ASP . 9.9 mtmp? 63.1 38.65 10.61 Favored 'General case' 0 C--N 1.365 1.258 0 C-N-CA 125.301 1.441 . . . . 0.0 111.999 -178.017 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 8.0 m -71.97 129.21 38.0 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 166.664 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 47.9 m -57.09 131.99 51.57 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 123.093 0.557 . . . . 0.0 110.551 178.629 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.437 HG13 HD11 ' A' ' 35' ' ' ILE . 38.0 mm -63.09 113.43 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 123.083 0.553 . . . . 0.0 111.051 -175.118 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 75.1 t -77.13 -56.76 7.14 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 170.67 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 62.6 m -153.21 136.17 15.48 Favored 'General case' 0 C--O 1.246 0.903 0 C-N-CA 123.312 0.645 . . . . 0.0 111.073 177.863 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 59.9 t -95.26 105.01 16.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 123.973 0.909 . . . . 0.0 108.667 170.724 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 23.6 mm-40 -97.26 146.75 24.82 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 172.649 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -75.29 112.17 11.31 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 172.435 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 57.7 t90 -75.25 133.4 41.37 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 123.415 0.686 . . . . 0.0 111.218 -174.136 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -106.14 132.02 52.7 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.941 0.897 . . . . 0.0 109.042 176.038 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -81.81 106.24 13.58 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-O 120.979 0.419 . . . . 0.0 110.235 176.851 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.115 0 N-CA-C 110.446 -1.062 . . . . 0.0 110.446 177.272 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 21.7 m . . . . . 0 N--CA 1.479 0.982 0 CA-C-O 120.286 0.089 . . . . 0.0 110.908 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 73.4 m80 -80.38 167.1 20.63 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 123.197 0.599 . . . . 0.0 111.651 -179.204 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.451 ' HA ' ' HD3' ' A' ' 4' ' ' PRO . 88.2 mtp -83.62 130.12 57.1 Favored Pre-proline 0 CA--C 1.55 0.956 0 C-N-CA 123.464 0.706 . . . . 0.0 110.074 176.976 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.451 ' HD3' ' HA ' ' A' ' 3' ' ' MET . 31.4 Cg_exo -61.66 -19.46 65.15 Favored 'Trans proline' 0 C--N 1.384 2.444 0 C-N-CA 123.494 2.796 . . . . 0.0 114.684 -175.606 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 25.3 m 70.25 159.95 0.2 Allowed 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.565 1.146 . . . . 0.0 110.618 -177.539 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 12.3 p -57.38 135.99 56.57 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.189 0.596 . . . . 0.0 110.465 171.526 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -68.23 -56.0 10.24 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.388 0.675 . . . . 0.0 111.546 -172.138 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.732 ' HB2' ' HG ' ' A' ' 10' ' ' LEU . 39.8 mt-10 53.39 -152.1 0.31 Allowed 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 124.6 1.16 . . . . 0.0 111.564 175.156 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -96.3 27.55 3.68 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.296 0.638 . . . . 0.0 109.805 167.966 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.732 ' HG ' ' HB2' ' A' ' 8' ' ' GLU . 85.1 mt -68.05 145.0 54.85 Favored 'General case' 0 C--N 1.352 0.68 0 C-N-CA 123.223 0.609 . . . . 0.0 111.197 -178.826 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 41.2 t -60.32 118.66 35.65 Favored Pre-proline 0 CA--C 1.545 0.77 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.486 173.85 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -65.92 -15.16 47.8 Favored 'Trans proline' 0 N--CA 1.5 1.877 0 C-N-CA 122.549 2.166 . . . . 0.0 113.013 -174.352 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 43.8 mt -85.96 -20.06 8.15 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.205 0 C-N-CA 124.478 1.111 . . . . 0.0 111.034 -178.462 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 39.8 m -134.39 -51.62 0.81 Allowed 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -169.679 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 78.95 -40.08 0.24 Allowed 'General case' 0 N--CA 1.498 1.954 0 C-N-CA 126.194 1.798 . . . . 0.0 112.981 -178.345 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.18 -14.66 56.73 Favored 'General case' 0 CA--C 1.559 1.3 0 N-CA-C 113.121 0.786 . . . . 0.0 113.121 -177.083 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 57.7 m-70 -137.77 150.36 67.6 Favored Pre-proline 0 N--CA 1.485 1.288 0 C-N-CA 124.049 0.94 . . . . 0.0 109.458 172.123 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.656 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 87.6 Cg_endo -76.02 -165.7 0.32 Allowed 'Trans proline' 0 C--N 1.382 2.341 0 C-N-CA 123.144 2.563 . . . . 0.0 113.762 178.107 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 65.9 mt -78.29 149.28 5.83 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.93 0 C-N-CA 123.448 0.699 . . . . 0.0 110.445 175.656 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.6 m -136.13 -32.65 0.86 Allowed 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.628 0.771 . . . . 0.0 111.079 -179.213 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -130.21 152.9 49.14 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.547 0.739 . . . . 0.0 111.584 -170.26 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.47 HG13 HE22 ' A' ' 24' ' ' GLN . 7.2 p -128.53 138.69 53.94 Favored 'Isoleucine or valine' 0 C--O 1.244 0.771 0 C-N-CA 124.828 1.251 . . . . 0.0 108.29 176.066 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 19.0 m-85 -107.27 105.62 15.68 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.094 0.558 . . . . 0.0 110.782 -169.305 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.47 HE22 HG13 ' A' ' 22' ' ' VAL . 2.9 mp0 -82.6 149.37 60.57 Favored Pre-proline 0 N--CA 1.474 0.735 0 C-N-CA 123.976 0.91 . . . . 0.0 110.469 174.804 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -97.15 81.64 0.13 OUTLIER 'Cis proline' 0 C--N 1.369 1.619 0 CA-C-N 118.853 0.626 . . . . 0.0 110.871 -3.304 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 36.6 t -143.11 -64.52 0.4 Allowed 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.861 -0.609 . . . . 0.0 112.127 -175.92 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 114.96 -12.03 20.28 Favored Glycine 0 C--N 1.345 1.032 0 CA-C-O 118.884 -0.953 . . . . 0.0 113.79 -176.576 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.424 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 6.1 m170 -58.31 139.42 55.25 Favored 'General case' 0 N--CA 1.491 1.606 0 CA-C-N 118.17 0.985 . . . . 0.0 110.207 171.541 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 57.4 mttp -130.41 156.28 45.0 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.318 0.647 . . . . 0.0 110.729 -174.136 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 92.9 p -169.0 -179.39 3.62 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.27 1.028 . . . . 0.0 109.11 174.028 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 13.6 p -69.04 148.91 49.37 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 173.331 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -71.03 -18.16 62.59 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-N 117.859 0.3 . . . . 0.0 111.667 -174.53 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.17 -34.38 74.95 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 122.369 0.268 . . . . 0.0 111.47 171.901 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.7 m -60.86 -51.72 68.11 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.496 0.718 . . . . 0.0 111.243 177.223 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.426 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 10.0 tp -71.33 -31.81 44.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 O-C-N 123.236 0.335 . . . . 0.0 110.849 -176.67 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 4.7 t30 -60.93 -46.49 90.46 Favored 'General case' 0 N--CA 1.48 1.05 0 CA-C-O 121.288 0.566 . . . . 0.0 109.967 174.767 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 63.7 tt0 -72.09 -27.12 62.45 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.083 178.537 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 47.3 t60 -77.17 -39.24 49.7 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 122.802 0.441 . . . . 0.0 110.674 -177.777 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 69.6 mt -66.33 -25.44 66.82 Favored 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 112.828 0.677 . . . . 0.0 112.828 -173.276 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 26.6 ptm -75.19 -14.15 60.52 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 122.541 0.336 . . . . 0.0 111.482 175.852 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 46.1 m-80 -105.87 -67.22 0.94 Allowed 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.203 0.601 . . . . 0.0 110.401 175.92 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 41.5 m-80 -132.17 -168.37 2.03 Favored 'General case' 0 N--CA 1.49 1.537 0 C-N-CA 124.871 1.268 . . . . 0.0 110.75 -176.054 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 82.4 tttt -135.62 9.41 3.38 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 123.389 0.675 . . . . 0.0 110.776 176.55 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.413 ' HB2' ' HA ' ' A' ' 49' ' ' LYS . 3.7 p30 -74.64 167.61 21.44 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-O 121.336 0.588 . . . . 0.0 111.372 -179.444 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.424 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 53.5 t -90.24 52.75 2.31 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.561 0.744 . . . . 0.0 110.877 -177.875 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 35.6 m-85 54.97 -80.25 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 126.084 1.754 . . . . 0.0 113.262 172.644 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 48.8 m-85 -83.58 -62.69 1.51 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.334 1.054 . . . . 0.0 110.732 -172.214 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 9.4 p -80.34 -7.95 59.29 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 122.829 0.451 . . . . 0.0 111.959 -173.803 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.413 ' HA ' ' HB2' ' A' ' 44' ' ' ASP . 74.4 mmtt 67.99 11.52 8.4 Favored 'General case' 0 N--CA 1.484 1.27 0 N-CA-C 114.583 1.327 . . . . 0.0 114.583 172.686 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 39.3 m -64.12 136.35 57.18 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 122.886 0.474 . . . . 0.0 111.025 176.826 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 90.0 m -63.06 119.91 10.42 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 122.861 0.464 . . . . 0.0 110.305 176.58 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.416 HD11 ' HA ' ' A' ' 45' ' ' CYS . 53.3 mt -79.13 104.29 6.96 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.797 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 -178.531 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 88.0 t -75.05 -31.38 24.85 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.818 0 C-N-CA 123.722 0.809 . . . . 0.0 110.735 177.668 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.3 t -151.7 134.18 15.39 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-O 120.678 0.275 . . . . 0.0 111.036 179.516 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 59.3 t -105.11 103.42 15.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 171.718 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -109.28 146.04 34.94 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.094 0.558 . . . . 0.0 110.556 -175.317 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -72.09 106.69 4.43 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.239 0.616 . . . . 0.0 110.347 -177.61 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 60.3 t90 -81.12 112.49 18.53 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 176.827 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -107.66 119.57 39.8 Favored 'General case' 0 C--O 1.239 0.55 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 174.651 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -70.48 -47.89 58.38 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.165 0.507 . . . . 0.0 110.23 -178.829 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.85 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.772 -177.733 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 43.2 m . . . . . 0 N--CA 1.487 1.39 0 CA-C-O 120.286 0.089 . . . . 0.0 110.869 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 65.9 m-70 60.31 91.38 0.05 Allowed 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.869 1.268 . . . . 0.0 111.428 -177.478 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 38.9 mtm -80.18 120.65 80.27 Favored Pre-proline 0 CA--C 1.55 0.975 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 174.105 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_exo -67.37 147.72 78.32 Favored 'Trans proline' 0 C--N 1.376 1.981 0 C-N-CA 122.339 2.026 . . . . 0.0 112.043 178.117 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.7 m 69.63 13.82 8.21 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 124.943 1.297 . . . . 0.0 111.621 178.948 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 68.5 m -76.81 -47.72 20.65 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 122.907 0.483 . . . . 0.0 109.748 174.043 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 56.92 -164.43 0.16 Allowed 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 124.469 1.108 . . . . 0.0 111.816 174.44 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.686 ' HB3' ' HG ' ' A' ' 10' ' ' LEU . 7.8 tp10 66.81 176.32 0.24 Allowed 'General case' 0 CA--C 1.56 1.353 0 C-N-CA 124.077 0.951 . . . . 0.0 111.312 172.41 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -83.28 39.2 0.64 Allowed 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.306 0.642 . . . . 0.0 110.448 169.98 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.686 ' HG ' ' HB3' ' A' ' 8' ' ' GLU . 63.1 mt -59.65 120.95 10.43 Favored 'General case' 0 C--N 1.354 0.803 0 C-N-CA 123.012 0.525 . . . . 0.0 110.755 -179.259 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.576 ' SG ' ' HB2' ' A' ' 30' ' ' SER . 43.0 t -47.38 112.0 1.87 Allowed Pre-proline 0 N--CA 1.476 0.857 0 C-N-CA 125.291 1.436 . . . . 0.0 110.617 -177.009 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -60.25 -16.66 41.98 Favored 'Trans proline' 0 N--CA 1.506 2.264 0 C-N-CA 123.041 2.494 . . . . 0.0 114.085 -169.137 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 68.4 mt -81.26 -43.13 20.27 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.108 0 C-N-CA 124.052 0.941 . . . . 0.0 110.787 177.16 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 93.1 m -97.69 -41.87 7.9 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 123.864 0.866 . . . . 0.0 112.498 -168.899 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 75.48 -46.45 0.57 Allowed 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 126.756 2.022 . . . . 0.0 112.333 -176.113 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.05 -37.38 87.38 Favored 'General case' 0 N--CA 1.484 1.256 0 N-CA-C 113.75 1.018 . . . . 0.0 113.75 -173.376 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 44.5 m170 -121.44 152.82 58.52 Favored Pre-proline 0 N--CA 1.484 1.26 0 C-N-CA 123.479 0.711 . . . . 0.0 109.521 -177.734 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.606 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 49.4 Cg_endo -82.4 -170.28 0.91 Allowed 'Trans proline' 0 C--N 1.379 2.151 0 C-N-CA 123.138 2.559 . . . . 0.0 114.243 -175.273 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.413 HG21 ' HB3' ' A' ' 29' ' ' LYS . 88.8 mt -81.38 140.24 16.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 123.674 0.79 . . . . 0.0 109.965 178.693 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.0 m -140.64 3.85 1.9 Allowed 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.224 0.61 . . . . 0.0 111.276 -177.104 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -152.92 157.27 40.39 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.116 0.566 . . . . 0.0 112.199 -171.131 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.9 p -135.06 140.27 45.57 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 C-N-CA 124.301 1.041 . . . . 0.0 109.185 174.249 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -99.94 99.45 10.22 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.79 0.836 . . . . 0.0 110.704 -173.459 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -72.59 146.94 89.15 Favored Pre-proline 0 N--CA 1.481 1.109 0 C-N-CA 123.845 0.858 . . . . 0.0 111.559 173.303 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 15.8 Cg_endo -95.24 28.41 17.22 Favored 'Cis proline' 0 C--N 1.377 2.027 0 C-N-CA 125.561 -0.6 . . . . 0.0 112.022 -3.621 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 36.9 t -81.36 -74.81 0.31 Allowed 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.447 0.699 . . . . 0.0 111.611 -176.041 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 136.2 -21.93 3.44 Favored Glycine 0 C--N 1.351 1.381 0 CA-C-O 119.362 -0.688 . . . . 0.0 113.927 -177.31 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.411 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 13.4 m170 -58.93 142.83 49.79 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 123.077 0.551 . . . . 0.0 111.174 178.632 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.413 ' HB3' HG21 ' A' ' 19' ' ' ILE . 53.7 mttm -129.35 145.64 51.35 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.62 0.768 . . . . 0.0 110.817 -169.526 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.576 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 96.0 p -165.65 -177.3 4.29 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.51 1.124 . . . . 0.0 108.389 173.572 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 14.1 p -66.25 142.83 57.55 Favored 'General case' 0 N--CA 1.478 0.935 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 172.17 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -62.69 -29.88 70.98 Favored 'General case' 0 N--CA 1.487 1.381 0 CA-C-N 117.888 0.313 . . . . 0.0 111.57 -177.288 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -53.85 -30.52 45.82 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.419 1.088 . . . . 0.0 112.633 176.272 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.3 m -59.28 -56.87 16.56 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.702 0.801 . . . . 0.0 111.11 175.758 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.562 HG21 HG11 ' A' ' 55' ' ' VAL . 8.3 tp -76.53 -21.71 15.09 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.68 0 O-C-N 123.351 0.407 . . . . 0.0 110.918 -174.725 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -66.03 -41.78 90.46 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 173.305 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -69.97 -40.78 75.17 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.397 0.679 . . . . 0.0 110.623 173.891 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.462 ' HB3' HD12 ' A' ' 35' ' ' ILE . 78.5 t60 -70.79 -34.32 71.66 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.97 -172.691 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 54.3 mt -71.06 -10.94 60.61 Favored 'General case' 0 N--CA 1.494 1.749 0 CA-C-N 118.364 0.529 . . . . 0.0 112.277 179.79 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 52.8 mtt -77.18 -17.4 58.58 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.381 0.673 . . . . 0.0 110.227 170.568 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 30.1 t30 -112.28 -75.12 0.61 Allowed 'General case' 0 CA--C 1.558 1.284 0 C-N-CA 124.929 1.292 . . . . 0.0 110.388 179.338 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -127.27 173.65 9.58 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 124.246 1.018 . . . . 0.0 110.961 -176.785 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -112.04 18.59 18.61 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 122.905 0.482 . . . . 0.0 111.556 -176.65 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -96.16 165.71 12.1 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-O 121.4 0.619 . . . . 0.0 112.595 -169.454 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.411 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 53.2 t -94.62 46.05 1.13 Allowed 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.791 0.836 . . . . 0.0 111.69 -174.843 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 77.5 m-85 54.19 -82.9 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 125.908 1.683 . . . . 0.0 113.54 172.524 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -71.49 -63.12 1.18 Allowed 'General case' 0 C--N 1.348 0.51 0 C-N-CA 124.32 1.048 . . . . 0.0 110.436 -171.726 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 14.6 p -79.74 -14.54 58.65 Favored 'General case' 0 N--CA 1.484 1.233 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.282 -176.254 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 88.8 mttt 64.31 14.98 9.14 Favored 'General case' 0 N--CA 1.494 1.74 0 C-N-CA 124.996 1.318 . . . . 0.0 113.518 175.681 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 16.8 m -67.77 121.91 16.97 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 174.668 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 35.2 m -62.72 117.37 6.21 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-O 121.198 0.523 . . . . 0.0 110.187 -179.102 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 57.9 mt -72.46 129.88 35.63 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 C-N-CA 124.669 1.188 . . . . 0.0 111.132 -173.282 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 76.3 t -79.62 -55.39 9.33 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 172.866 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.9 m -137.54 144.91 42.34 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.396 0.678 . . . . 0.0 110.284 -173.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.562 HG11 HG21 ' A' ' 35' ' ' ILE . 56.1 t -117.05 119.07 60.85 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 N-CA-C 108.493 -0.928 . . . . 0.0 108.493 171.389 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -99.92 168.32 9.95 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 122.999 0.52 . . . . 0.0 110.525 174.362 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -93.69 101.03 13.15 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 174.223 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 29.8 t90 -73.22 109.62 6.89 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-O 120.87 0.367 . . . . 0.0 110.955 -174.092 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -74.08 148.89 41.47 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.114 0.965 . . . . 0.0 109.339 171.824 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.42 178.71 5.34 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.287 1.035 . . . . 0.0 109.882 -171.691 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.256 1.51 0 CA-C-O 118.812 -0.993 . . . . 0.0 112.454 176.644 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 20.3 m . . . . . 0 N--CA 1.47 0.567 0 N-CA-C 111.202 0.075 . . . . 0.0 111.202 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -137.16 142.34 42.21 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.96 0.904 . . . . 0.0 109.876 -178.746 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 57.3 ttm -99.15 134.57 21.24 Favored Pre-proline 0 N--CA 1.48 1.074 0 C-N-CA 123.892 0.877 . . . . 0.0 108.991 176.641 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -56.21 103.3 0.11 Allowed 'Trans proline' 0 C--N 1.387 2.57 0 C-N-CA 122.891 2.394 . . . . 0.0 111.96 176.94 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 26.8 p -77.24 83.57 3.71 Favored 'General case' 0 CA--C 1.547 0.855 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.37 -175.314 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.548 ' HB3' HD12 ' A' ' 10' ' ' LEU . 52.7 m -82.83 126.53 32.54 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 115.052 -0.976 . . . . 0.0 110.014 178.281 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -95.94 33.55 1.68 Allowed 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 124.009 0.923 . . . . 0.0 111.005 -175.053 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -153.06 167.32 29.61 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.806 0.842 . . . . 0.0 109.22 -175.27 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -79.83 58.29 2.8 Favored 'General case' 0 N--CA 1.485 1.301 0 CA-C-O 122.704 1.24 . . . . 0.0 111.177 176.901 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.548 HD12 ' HB3' ' A' ' 6' ' ' SER . 81.4 mt -82.6 171.95 13.49 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-N 114.618 -1.174 . . . . 0.0 109.634 174.721 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.452 ' SG ' ' HB2' ' A' ' 30' ' ' SER . 51.9 t -56.52 112.57 4.63 Favored Pre-proline 0 N--CA 1.484 1.251 0 CA-C-O 118.74 -0.647 . . . . 0.0 110.079 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -61.08 -17.18 50.53 Favored 'Trans proline' 0 C--N 1.377 2.078 0 C-N-CA 123.307 2.671 . . . . 0.0 113.375 -172.257 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 68.9 mt -84.55 -48.45 16.71 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.064 0 C-N-CA 124.031 0.932 . . . . 0.0 110.906 176.629 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 90.1 m -86.41 -53.24 5.12 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.152 0.581 . . . . 0.0 111.801 -171.915 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 78.39 -40.32 0.28 Allowed 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 126.515 1.926 . . . . 0.0 112.329 -175.303 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -78.0 -10.71 59.73 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 113.093 0.775 . . . . 0.0 113.093 -176.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -139.96 154.31 70.4 Favored Pre-proline 0 N--CA 1.483 1.206 0 C-N-CA 123.851 0.86 . . . . 0.0 109.383 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.526 ' HB2' ' HG3' ' A' ' 60' ' ' LYS . 82.0 Cg_endo -77.15 -173.69 1.89 Allowed 'Trans proline' 0 C--N 1.38 2.192 0 C-N-CA 123.045 2.497 . . . . 0.0 114.232 -174.334 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.512 HG21 ' HB3' ' A' ' 29' ' ' LYS . 67.5 mt -89.27 143.33 11.39 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.807 0 CA-C-N 114.767 -1.106 . . . . 0.0 109.659 175.586 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 78.4 p -150.13 19.73 0.87 Allowed 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.134 0.573 . . . . 0.0 111.195 179.683 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -158.38 138.42 12.27 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.477 0.711 . . . . 0.0 110.704 -178.866 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 10.5 p -116.69 139.93 41.36 Favored 'Isoleucine or valine' 0 C--O 1.245 0.824 0 C-N-CA 124.096 0.958 . . . . 0.0 109.213 171.069 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 15.0 m-85 -97.46 86.7 3.93 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 176.733 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.523 ' HG3' ' HA ' ' A' ' 25' ' ' PRO . 8.5 tt0 -91.21 140.98 25.87 Favored Pre-proline 0 CA--C 1.553 1.084 0 N-CA-C 108.358 -0.978 . . . . 0.0 108.358 -173.893 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.523 ' HA ' ' HG3' ' A' ' 24' ' ' GLN . 12.0 Cg_endo -94.09 22.82 28.16 Favored 'Cis proline' 0 C--N 1.387 2.583 0 N-CA-C 116.246 1.595 . . . . 0.0 116.246 7.609 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 35.3 t -68.52 -63.91 0.97 Allowed 'General case' 0 N--CA 1.481 1.08 0 CA-C-N 118.315 0.507 . . . . 0.0 111.572 178.945 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 124.82 -25.5 5.84 Favored Glycine 0 C--N 1.35 1.312 0 CA-C-O 119.323 -0.71 . . . . 0.0 113.17 -177.222 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.415 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 10.0 m170 -56.15 140.01 45.59 Favored 'General case' 0 N--CA 1.49 1.574 0 CA-C-N 117.25 0.525 . . . . 0.0 110.498 173.87 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.512 ' HB3' HG21 ' A' ' 19' ' ' ILE . 61.2 mttp -133.99 151.42 51.45 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.905 0.882 . . . . 0.0 110.634 -173.429 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.452 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 89.1 p -164.51 -173.86 3.22 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.82 1.248 . . . . 0.0 107.842 173.606 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.42 ' SG ' ' HB3' ' A' ' 33' ' ' ALA . 20.0 p -79.12 149.99 31.89 Favored 'General case' 0 C--O 1.244 0.766 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 173.94 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 63.2 pttt -65.6 -18.1 65.07 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.161 0.584 . . . . 0.0 112.169 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.42 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . . . -62.13 -40.75 96.98 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 123.318 0.647 . . . . 0.0 111.332 172.515 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.8 m -59.52 -52.8 64.01 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.618 0.767 . . . . 0.0 111.174 179.273 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.567 HG21 HG11 ' A' ' 55' ' ' VAL . 9.3 tp -73.18 -32.89 40.15 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.708 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.99 -174.41 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -61.47 -44.95 96.19 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-O 121.014 0.435 . . . . 0.0 109.986 177.567 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -60.15 -40.29 89.36 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 114.784 -1.098 . . . . 0.0 110.974 173.693 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 73.0 t60 -73.85 -33.15 63.99 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 114.759 -1.109 . . . . 0.0 111.698 -174.841 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 78.8 mt -71.79 -9.13 57.86 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 123.521 0.729 . . . . 0.0 112.102 -176.522 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 17.5 mmt -74.72 -24.6 58.76 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 123.18 0.592 . . . . 0.0 109.747 172.274 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 39.2 t30 -111.34 -73.13 0.69 Allowed 'General case' 0 CA--C 1.555 1.141 0 C-N-CA 124.532 1.133 . . . . 0.0 110.344 -178.8 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -120.71 -175.17 2.97 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 123.976 0.91 . . . . 0.0 111.15 -175.434 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt -136.63 20.25 3.1 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 123.831 0.852 . . . . 0.0 109.6 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -85.85 164.13 17.7 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 121.291 0.567 . . . . 0.0 110.868 -177.789 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.415 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 53.5 t -91.39 38.65 0.98 Allowed 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.067 0.947 . . . . 0.0 111.97 -173.165 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 57.43 -84.66 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 125.756 1.622 . . . . 0.0 112.627 171.416 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 -67.64 -50.43 58.02 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.593 1.157 . . . . 0.0 110.644 -169.222 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 14.7 p -97.63 -7.85 30.17 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.387 -177.824 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt 59.94 13.19 3.51 Favored 'General case' 0 CA--C 1.57 1.744 0 C-N-CA 125.506 1.522 . . . . 0.0 114.299 177.581 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 55.7 m -64.32 134.17 54.13 Favored 'General case' 0 N--CA 1.479 0.979 0 O-C-N 121.249 -0.907 . . . . 0.0 110.44 176.703 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 25.6 m -63.11 112.54 2.68 Favored 'General case' 0 C--O 1.245 0.868 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 177.75 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.503 HG21 HG22 ' A' ' 55' ' ' VAL . 30.5 mt -69.49 124.02 24.44 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 O-C-N 123.728 0.642 . . . . 0.0 109.825 -174.737 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 89.7 t -71.01 -51.31 36.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 O-C-N 123.705 0.628 . . . . 0.0 109.799 177.15 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 36.2 p -143.34 133.18 23.98 Favored 'General case' 0 C--O 1.249 1.026 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.703 178.595 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.567 HG11 HG21 ' A' ' 35' ' ' ILE . 23.3 t -102.04 106.97 20.69 Favored 'Isoleucine or valine' 0 C--N 1.348 0.528 0 N-CA-C 107.933 -1.136 . . . . 0.0 107.933 174.355 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -115.7 157.4 24.32 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.63 0.772 . . . . 0.0 110.215 -174.059 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -77.96 128.1 33.39 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.479 ' CZ3' ' HA ' ' A' ' 60' ' ' LYS . 74.7 t90 -114.19 105.04 12.71 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 175.526 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -61.23 124.98 22.11 Favored 'General case' 0 C--O 1.242 0.686 0 C-N-CA 123.311 0.644 . . . . 0.0 109.373 173.687 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.526 ' HG3' ' HB2' ' A' ' 18' ' ' PRO . 11.9 tmtt? -66.47 -59.17 3.91 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.851 0.86 . . . . 0.0 110.895 -169.374 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.986 0 CA-C-O 118.771 -1.016 . . . . 0.0 112.839 -179.48 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 54.5 p . . . . . 0 N--CA 1.481 1.095 0 CA-C-O 120.62 0.248 . . . . 0.0 110.773 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 4.7 p80 -80.65 158.35 25.67 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.348 0.659 . . . . 0.0 110.264 176.327 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 15.7 ptm -149.66 74.82 9.45 Favored Pre-proline 0 CA--C 1.554 1.134 0 C-N-CA 123.682 0.793 . . . . 0.0 109.614 -175.995 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_exo -65.17 -49.08 2.91 Favored 'Trans proline' 0 C--N 1.381 2.253 0 C-N-CA 122.92 2.413 . . . . 0.0 112.174 -177.442 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 18.1 p -118.46 98.52 6.3 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.737 1.215 . . . . 0.0 109.426 -177.836 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 64.8 m -133.38 104.42 6.42 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.788 0.835 . . . . 0.0 109.023 179.14 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -116.26 -77.63 0.57 Allowed 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 -178.03 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -170.55 172.92 5.71 Favored 'General case' 0 C--O 1.247 0.937 0 C-N-CA 125.111 1.365 . . . . 0.0 108.733 175.285 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 58.17 36.24 25.67 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 124.164 0.986 . . . . 0.0 109.76 -172.915 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.621 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 90.2 mt -74.95 139.9 43.33 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.404 0.682 . . . . 0.0 110.097 -176.92 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 50.5 t -57.95 115.05 9.85 Favored Pre-proline 0 CA--C 1.548 0.901 0 O-C-N 123.874 0.734 . . . . 0.0 109.794 178.455 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_endo -57.45 -18.11 30.22 Favored 'Trans proline' 0 N--CA 1.508 2.335 0 C-N-CA 123.505 2.803 . . . . 0.0 114.034 -172.704 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 56.7 mt -90.29 -42.62 14.22 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.068 0 C-N-CA 123.954 0.902 . . . . 0.0 111.629 178.675 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 77.7 m -95.24 -53.37 3.81 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 123.114 0.566 . . . . 0.0 110.852 -171.645 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 20.4 t80 80.02 -41.57 0.22 Allowed 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 126.458 1.903 . . . . 0.0 112.617 175.192 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -70.03 -15.1 62.96 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.674 0.79 . . . . 0.0 112.128 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 33.7 m170 -132.1 153.38 81.32 Favored Pre-proline 0 CA--C 1.551 1.017 0 C-N-CA 124.402 1.081 . . . . 0.0 108.588 178.177 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.621 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 60.9 Cg_endo -78.82 -166.23 0.39 Allowed 'Trans proline' 0 C--N 1.379 2.141 0 C-N-CA 123.124 2.549 . . . . 0.0 113.67 -175.238 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.415 HD13 ' HB2' ' A' ' 29' ' ' LYS . 91.3 mt -96.9 146.07 7.99 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.696 0 C-N-CA 124.733 1.213 . . . . 0.0 109.313 174.185 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 28.1 t -141.96 -14.7 0.81 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 123.132 0.573 . . . . 0.0 111.805 176.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -130.95 134.21 46.52 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.135 0.574 . . . . 0.0 110.836 -174.792 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.485 ' HB ' ' HB2' ' A' ' 58' ' ' TRP . 7.3 p -115.85 140.34 38.14 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 124.041 0.937 . . . . 0.0 110.288 176.227 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -84.71 89.6 7.54 Favored 'General case' 0 C--O 1.242 0.66 0 C-N-CA 124.454 1.101 . . . . 0.0 108.471 175.217 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.4 ' HB3' ' HB3' ' A' ' 54' ' ' SER . 35.7 tt0 -82.18 140.77 45.95 Favored Pre-proline 0 CA--C 1.552 1.034 0 C-N-CA 124.325 1.05 . . . . 0.0 109.988 -177.058 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 14.9 Cg_endo -97.95 31.15 12.26 Favored 'Cis proline' 0 C--N 1.384 2.4 0 CA-C-N 120.226 1.116 . . . . 0.0 114.195 1.743 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 43.5 t -75.02 -40.91 60.26 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -177.656 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 85.52 23.64 46.31 Favored Glycine 0 C--N 1.345 1.045 0 C-N-CA 121.619 -0.324 . . . . 0.0 113.655 -176.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.502 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 24.8 m170 -104.59 147.84 27.18 Favored 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 166.812 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.432 ' HG3' HG23 ' A' ' 22' ' ' VAL . 6.3 mptt -132.41 169.47 16.48 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-O 121.602 0.715 . . . . 0.0 112.126 -171.039 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 84.3 p -169.19 -166.43 0.62 Allowed 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.664 1.586 . . . . 0.0 107.594 170.225 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 19.0 p -89.37 154.42 20.08 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 168.248 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.9 -33.99 72.6 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.415 0.686 . . . . 0.0 110.859 -176.551 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -54.88 -40.54 69.85 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.9 0.88 . . . . 0.0 112.52 177.519 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 9.0 m -62.01 -54.56 39.91 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.553 0.741 . . . . 0.0 111.21 178.577 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.411 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 9.5 tp -69.53 -32.55 53.28 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 O-C-N 123.055 0.222 . . . . 0.0 110.739 -175.935 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 4.6 t30 -58.77 -48.03 82.66 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.643 0.777 . . . . 0.0 110.626 176.954 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -62.46 -42.18 99.3 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 114.866 -1.061 . . . . 0.0 111.014 176.117 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 52.2 t60 -63.49 -38.52 91.45 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.695 0.798 . . . . 0.0 111.049 -178.749 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.411 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 96.1 mt -69.81 -11.29 60.74 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.809 0.844 . . . . 0.0 112.051 -177.116 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 45.6 mtm -76.48 -15.22 59.95 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 122.821 0.448 . . . . 0.0 111.059 172.545 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 19.3 m-80 -121.09 -64.91 1.19 Allowed 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 124.463 1.105 . . . . 0.0 110.376 -173.726 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 31.1 m-80 -126.81 -174.42 3.13 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 124.842 1.257 . . . . 0.0 109.468 -177.376 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp -137.18 68.89 1.41 Allowed 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 178.063 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.1 m-20 -139.21 165.79 26.24 Favored 'General case' 0 N--CA 1.494 1.726 0 CA-C-O 121.908 0.861 . . . . 0.0 112.076 -168.616 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.502 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 43.7 t -89.67 24.32 2.37 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 125.154 1.382 . . . . 0.0 112.239 -172.03 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 58.93 -86.0 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 125.158 1.383 . . . . 0.0 112.495 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -67.64 -40.39 84.59 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 125.407 1.483 . . . . 0.0 111.382 -162.239 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 7.5 p -108.74 -2.48 18.56 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.181 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 64.5 tttp 66.97 -2.27 1.19 Allowed 'General case' 0 CA--C 1.565 1.526 0 N-CA-C 114.657 1.355 . . . . 0.0 114.657 174.054 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 24.2 m -55.77 124.29 17.02 Favored 'General case' 0 N--CA 1.489 1.523 0 CA-C-N 119.16 0.891 . . . . 0.0 111.112 178.671 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 89.2 m -57.28 134.54 56.05 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.289 0.635 . . . . 0.0 111.674 -178.549 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 48.8 mm -62.38 118.67 4.95 Favored 'Isoleucine or valine' 0 C--N 1.354 0.768 0 C-N-CA 123.511 0.724 . . . . 0.0 110.732 -176.241 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 59.9 t -90.92 -40.33 12.54 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 172.896 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.4 ' HB3' ' HB3' ' A' ' 24' ' ' GLN . 24.9 t -154.35 146.79 23.98 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.49 0.716 . . . . 0.0 110.148 179.061 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 66.0 t -112.66 103.19 15.05 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 168.59 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -97.25 156.36 16.46 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.528 0.731 . . . . 0.0 109.114 178.046 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -75.65 107.7 7.98 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 170.007 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.485 ' HB2' ' HB ' ' A' ' 22' ' ' VAL . 39.3 t90 -75.73 103.66 5.93 Favored 'General case' 0 C--O 1.241 0.651 0 O-C-N 123.237 0.336 . . . . 0.0 110.21 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -76.71 133.6 39.46 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 170.292 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -70.5 -22.9 62.59 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.816 0.846 . . . . 0.0 111.884 -176.042 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.969 0 N-CA-C 110.4 -1.08 . . . . 0.0 110.4 -175.411 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 35.4 p . . . . . 0 N--CA 1.478 0.95 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 44.9 t-80 66.67 117.45 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 125.715 1.606 . . . . 0.0 110.673 -179.101 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 11.8 tpt 58.25 64.92 3.42 Favored Pre-proline 0 CA--C 1.561 1.394 0 C-N-CA 124.595 1.158 . . . . 0.0 109.463 -170.544 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_exo -75.34 82.81 1.98 Allowed 'Trans proline' 0 C--N 1.385 2.497 0 C-N-CA 123.079 2.52 . . . . 0.0 111.509 -178.178 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 35.0 p -86.65 61.86 7.07 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 124.395 1.078 . . . . 0.0 110.574 179.496 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 46.1 m -126.49 118.83 25.73 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.279 1.031 . . . . 0.0 108.876 -178.695 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -100.59 109.37 21.45 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.283 0.633 . . . . 0.0 110.335 178.604 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.544 ' HG2' ' H ' ' A' ' 9' ' ' ASP . 32.8 tt0 -160.02 -179.8 8.09 Favored 'General case' 0 CA--C 1.56 1.333 0 C-N-CA 124.825 1.25 . . . . 0.0 107.938 179.053 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.544 ' H ' ' HG2' ' A' ' 8' ' ' GLU . 12.6 t70 -79.29 68.19 5.22 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-O 122.595 1.188 . . . . 0.0 108.524 170.959 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.612 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 92.8 mt -83.43 160.6 21.54 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 114.119 -1.4 . . . . 0.0 111.256 -176.721 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 42.5 t -61.61 119.26 45.66 Favored Pre-proline 0 N--CA 1.475 0.794 0 CA-C-O 118.744 -0.646 . . . . 0.0 110.37 178.223 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -67.0 -11.49 32.46 Favored 'Trans proline' 0 C--N 1.376 2.023 0 C-N-CA 122.746 2.297 . . . . 0.0 113.208 -177.748 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 68.4 mt -97.73 -28.41 3.69 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.153 0 C-N-CA 124.52 1.128 . . . . 0.0 111.886 -176.127 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 71.1 m -115.81 -38.87 3.59 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 122.841 0.456 . . . . 0.0 110.807 -173.188 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 11.0 t80 79.98 -54.77 0.38 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 126.703 2.001 . . . . 0.0 111.802 175.166 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.5 -38.95 85.99 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 124.084 0.953 . . . . 0.0 112.797 -175.619 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 65.2 m170 -103.88 153.93 38.42 Favored Pre-proline 0 N--CA 1.486 1.371 0 C-N-CA 123.712 0.805 . . . . 0.0 110.445 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.612 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 97.9 Cg_endo -75.27 -167.83 0.47 Allowed 'Trans proline' 0 C--N 1.38 2.221 0 C-N-CA 123.077 2.518 . . . . 0.0 113.597 -177.361 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.538 HG21 ' HB3' ' A' ' 29' ' ' LYS . 38.8 mt -96.94 147.29 6.41 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 C-N-CA 124.005 0.922 . . . . 0.0 109.938 174.676 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 34.3 p -154.87 25.12 0.44 Allowed 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.995 0.918 . . . . 0.0 110.542 179.141 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -152.56 141.81 21.47 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 124.167 0.987 . . . . 0.0 110.031 178.051 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 6.4 p -137.18 118.99 18.78 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 C-N-CA 124.236 1.014 . . . . 0.0 108.442 176.515 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -85.02 92.95 8.47 Favored 'General case' 0 C--O 1.244 0.812 0 N-CA-C 108.423 -0.955 . . . . 0.0 108.423 -174.907 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -83.42 152.62 64.49 Favored Pre-proline 0 CA--C 1.545 0.753 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.498 -178.167 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -89.78 18.12 39.52 Favored 'Cis proline' 0 C--N 1.38 2.223 0 N-CA-C 114.297 0.845 . . . . 0.0 114.297 0.413 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 36.6 t -65.4 -64.59 0.83 Allowed 'General case' 0 C--N 1.356 0.871 0 C-N-CA 123.064 0.545 . . . . 0.0 111.84 -176.549 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 125.67 -19.73 6.58 Favored Glycine 0 C--N 1.345 1.062 0 CA-C-O 118.951 -0.916 . . . . 0.0 113.465 -176.737 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.455 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 9.4 m170 -61.01 144.41 53.45 Favored 'General case' 0 N--CA 1.487 1.409 0 CA-C-N 117.733 0.766 . . . . 0.0 110.494 176.728 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.538 ' HB3' HG21 ' A' ' 19' ' ' ILE . 58.3 mttp -136.48 157.45 46.75 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 123.876 0.87 . . . . 0.0 110.798 -170.534 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 94.6 p -169.04 179.55 4.0 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.86 1.264 . . . . 0.0 108.556 171.739 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 14.4 p -68.12 142.17 55.86 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 171.343 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.99 -21.65 66.29 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -175.104 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -58.63 -38.47 78.14 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.881 0.873 . . . . 0.0 111.329 173.247 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.8 m -58.59 -55.63 32.53 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 124.07 0.948 . . . . 0.0 111.592 177.359 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.53 HG12 HG21 ' A' ' 55' ' ' VAL . 9.2 tp -73.6 -33.86 40.19 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 O-C-N 123.422 0.451 . . . . 0.0 111.19 -173.269 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -62.96 -41.03 99.41 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-O 120.944 0.402 . . . . 0.0 110.429 175.79 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -74.88 -28.67 60.74 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 123.685 0.794 . . . . 0.0 110.915 176.707 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 83.2 t60 -69.79 -45.81 67.15 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.841 0.856 . . . . 0.0 110.417 -178.259 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 97.4 mt -60.82 -19.08 59.06 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 124.083 0.953 . . . . 0.0 112.656 -176.356 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 84.4 mmm -61.56 -32.59 72.67 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.37 1.068 . . . . 0.0 112.002 173.651 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 77.3 m-20 -116.4 -58.24 2.11 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.34 0.656 . . . . 0.0 111.134 -176.787 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -122.71 160.66 25.41 Favored 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 124.144 0.977 . . . . 0.0 110.947 -176.936 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 47.6 mtpt -126.46 63.66 1.27 Allowed 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 174.844 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -128.59 158.12 39.37 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 115.136 -0.938 . . . . 0.0 109.944 -174.971 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.455 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 42.3 t -87.7 37.37 0.79 Allowed 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 123.675 0.79 . . . . 0.0 111.875 -176.396 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 57.6 -85.3 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 125.697 1.599 . . . . 0.0 112.775 173.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 -74.82 -39.07 61.86 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.639 1.176 . . . . 0.0 111.758 -165.217 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 14.2 p -107.05 -2.53 20.97 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 122.952 0.501 . . . . 0.0 110.994 -179.875 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 83.8 tttt 66.39 -4.18 0.74 Allowed 'General case' 0 CA--C 1.566 1.582 0 C-N-CA 125.492 1.517 . . . . 0.0 114.917 176.841 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 22.9 m -51.11 121.16 5.7 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 119.27 0.941 . . . . 0.0 111.128 -177.299 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 20.6 m -51.6 127.84 21.49 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.393 0.677 . . . . 0.0 110.772 -177.077 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.454 HG13 HD11 ' A' ' 35' ' ' ILE . 42.4 mm -60.71 103.28 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.353 0.724 0 O-C-N 123.756 0.66 . . . . 0.0 110.64 -175.542 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 47.4 t -75.76 -55.4 11.5 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 CA-C-N 115.047 -0.979 . . . . 0.0 108.44 174.207 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.8 t -153.57 153.06 31.66 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 123.128 0.571 . . . . 0.0 110.582 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.53 HG21 HG12 ' A' ' 35' ' ' ILE . 58.1 t -127.53 127.13 68.43 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 124.532 1.133 . . . . 0.0 108.462 175.428 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -108.64 143.72 37.34 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.599 0.76 . . . . 0.0 109.055 173.128 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -66.13 106.21 1.58 Allowed 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 108.428 -0.952 . . . . 0.0 108.428 174.313 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 72.1 t90 -69.46 95.55 0.83 Allowed 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 177.209 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -91.46 115.74 28.28 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 114.803 -1.089 . . . . 0.0 109.434 -178.799 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -71.27 146.29 49.04 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 122.754 0.421 . . . . 0.0 110.815 -179.753 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 1.426 0 CA-C-O 118.867 -0.963 . . . . 0.0 113.027 -177.155 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 23.2 t . . . . . 0 N--CA 1.475 0.796 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 49.2 m80 -58.91 117.9 5.16 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.292 0.637 . . . . 0.0 110.83 178.17 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 54.1 ttm -164.43 81.94 1.3 Allowed Pre-proline 0 CA--C 1.551 0.989 0 C-N-CA 124.355 1.062 . . . . 0.0 108.566 177.099 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -86.91 -166.96 0.33 Allowed 'Trans proline' 0 C--N 1.375 1.926 0 C-N-CA 123.037 2.491 . . . . 0.0 111.729 178.75 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 7.0 m 70.99 -5.88 1.41 Allowed 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 124.41 1.084 . . . . 0.0 112.748 173.21 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 21.1 m -80.85 83.78 6.51 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.961 0.904 . . . . 0.0 110.283 -172.762 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -126.76 100.34 6.15 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.58 0.752 . . . . 0.0 110.069 -178.454 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -163.31 -169.03 1.86 Allowed 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.773 1.229 . . . . 0.0 109.489 179.78 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -79.43 62.48 3.77 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 168.627 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.739 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 94.6 mt -83.76 153.81 23.92 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-N 114.828 -1.078 . . . . 0.0 111.777 -173.394 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.42 ' SG ' ' HB ' ' A' ' 13' ' ' ILE . 51.0 t -67.15 114.34 17.97 Favored Pre-proline 0 CA--C 1.545 0.759 0 CA-C-N 114.413 -1.267 . . . . 0.0 109.223 171.583 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -64.0 -8.28 15.66 Favored 'Trans proline' 0 C--N 1.374 1.897 0 C-N-CA 122.814 2.343 . . . . 0.0 113.353 -179.324 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.42 ' HB ' ' SG ' ' A' ' 11' ' ' CYS . 3.6 mp -84.52 -44.98 17.9 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.989 0 C-N-CA 124.186 0.994 . . . . 0.0 110.172 175.258 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 78.8 m -107.39 -46.87 3.76 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.348 0.659 . . . . 0.0 112.688 -165.885 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 97.6 m-85 76.81 -39.17 0.33 Allowed 'General case' 0 N--CA 1.499 2.012 0 C-N-CA 126.196 1.798 . . . . 0.0 113.419 178.337 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.75 -20.58 65.25 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.371 0.668 . . . . 0.0 112.797 -177.293 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 80.3 m-70 -134.72 152.74 78.14 Favored Pre-proline 0 C--O 1.248 0.977 0 C-N-CA 123.728 0.811 . . . . 0.0 109.371 -179.14 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.739 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 83.0 Cg_endo -72.66 -166.07 0.26 Allowed 'Trans proline' 0 C--N 1.38 2.224 0 C-N-CA 122.925 2.417 . . . . 0.0 113.822 -178.291 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.604 HG21 ' HB3' ' A' ' 29' ' ' LYS . 92.4 mt -94.64 146.0 7.33 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 C-N-CA 124.469 1.108 . . . . 0.0 108.63 172.922 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 18.9 t -147.33 9.36 0.95 Allowed 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.172 0.589 . . . . 0.0 110.922 178.26 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.412 ' HA ' ' HA ' ' A' ' 57' ' ' ASP . . . -142.29 141.96 32.48 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.173 0.589 . . . . 0.0 110.677 -179.014 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.1 p -119.35 136.99 54.73 Favored 'Isoleucine or valine' 0 C--O 1.245 0.83 0 C-N-CA 124.08 0.952 . . . . 0.0 109.491 177.763 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.408 ' HB3' HG12 ' A' ' 52' ' ' ILE . 10.3 m-30 -98.63 87.44 3.8 Favored 'General case' 0 C--O 1.241 0.644 0 C-N-CA 123.877 0.871 . . . . 0.0 109.057 -177.134 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 17.0 mt-30 -81.9 147.6 58.73 Favored Pre-proline 0 CA--C 1.546 0.803 0 CA-C-N 115.217 -0.901 . . . . 0.0 111.383 -176.403 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.497 ' HD3' ' HB ' ' A' ' 53' ' ' VAL . 43.6 Cg_endo -97.44 24.36 22.42 Favored 'Cis proline' 0 C--N 1.374 1.871 0 C-N-CA 125.322 -0.699 . . . . 0.0 113.384 -0.267 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 37.5 t -71.53 -49.37 41.49 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 122.696 0.398 . . . . 0.0 110.759 -179.102 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 108.79 -12.66 35.12 Favored Glycine 0 C--N 1.348 1.229 0 CA-C-O 119.429 -0.651 . . . . 0.0 114.032 179.119 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.414 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 11.1 m80 -64.53 143.51 57.86 Favored 'General case' 0 N--CA 1.484 1.269 0 CA-C-N 117.391 0.596 . . . . 0.0 110.351 173.487 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.604 ' HB3' HG21 ' A' ' 19' ' ' ILE . 96.2 mttt -135.54 149.6 49.51 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.632 0.773 . . . . 0.0 110.844 -168.831 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 47.2 t -157.64 173.75 16.38 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.253 1.021 . . . . 0.0 109.069 178.785 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 12.3 p -68.0 146.87 53.13 Favored 'General case' 0 C--O 1.243 0.757 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 176.161 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt -61.78 -28.25 69.32 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.456 0.702 . . . . 0.0 111.777 -174.479 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -62.68 -42.18 99.49 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.765 0.826 . . . . 0.0 111.933 178.798 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.1 m -56.09 -56.21 23.65 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.315 0.646 . . . . 0.0 111.271 178.408 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.443 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 7.7 tp -73.67 -34.37 41.08 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.75 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.285 -173.767 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -56.85 -46.76 81.56 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 123.294 0.637 . . . . 0.0 110.429 177.054 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -66.41 -40.64 89.71 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.68 176.271 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 82.5 t60 -74.16 -24.28 59.37 Favored 'General case' 0 C--O 1.215 -0.754 0 CA-C-N 115.272 -0.877 . . . . 0.0 112.722 -172.414 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.443 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 73.2 mt -61.95 -22.41 65.6 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 122.985 0.514 . . . . 0.0 111.976 -179.143 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 24.6 mmt -75.34 -31.14 60.47 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 123.697 0.799 . . . . 0.0 110.643 174.241 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 23.6 m-20 -84.18 -76.33 0.3 Allowed 'General case' 0 CA--C 1.553 1.058 0 C-N-CA 123.937 0.895 . . . . 0.0 109.251 177.895 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -141.45 -167.23 2.37 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 125.198 1.399 . . . . 0.0 109.641 -176.686 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -141.98 87.72 2.06 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 173.516 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -152.17 162.42 41.15 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.062 179.564 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.414 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 79.3 m -62.18 142.33 57.7 Favored 'General case' 0 C--N 1.347 0.465 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.206 173.605 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 71.1 m-85 -82.86 26.34 0.6 Allowed 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.379 0.672 . . . . 0.0 110.271 172.796 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 48.4 m-85 -139.38 -77.2 0.34 Allowed 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 124.21 1.004 . . . . 0.0 108.93 -169.11 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 1.8 p -95.07 -1.86 51.28 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.178 0.591 . . . . 0.0 111.394 -177.388 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 8.6 mtmp? 63.78 9.54 4.5 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 125.04 1.336 . . . . 0.0 113.928 176.598 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 87.4 m -65.6 128.84 37.57 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.236 0.614 . . . . 0.0 111.116 177.351 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 56.9 m -58.16 133.64 55.79 Favored 'General case' 0 C--N 1.352 0.695 0 O-C-N 124.456 1.098 . . . . 0.0 111.512 178.306 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.451 HG21 HG22 ' A' ' 55' ' ' VAL . 30.8 mt -86.6 119.9 35.33 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 C-N-CA 123.907 0.883 . . . . 0.0 109.716 -177.621 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.497 ' HB ' ' HD3' ' A' ' 25' ' ' PRO . 61.1 t -78.91 -35.46 17.86 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.922 0 C-N-CA 123.096 0.558 . . . . 0.0 109.96 178.85 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.7 t -145.91 131.7 19.03 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 122.941 0.496 . . . . 0.0 110.331 175.46 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.451 HG22 HG21 ' A' ' 52' ' ' ILE . 56.6 t -100.48 111.89 31.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 175.771 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -117.71 -178.52 3.5 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 123.095 0.558 . . . . 0.0 110.179 174.544 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.412 ' HA ' ' HA ' ' A' ' 21' ' ' ALA . 35.9 m-20 -100.05 164.37 12.02 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.589 0.756 . . . . 0.0 109.947 178.446 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 54.7 t90 -139.83 111.75 7.45 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 179.594 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -80.41 151.15 29.5 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.163 0.585 . . . . 0.0 110.26 177.592 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -155.66 129.74 8.74 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 177.812 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.095 0 N-CA-C 111.053 -0.819 . . . . 0.0 111.053 178.891 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 25.9 p . . . . . 0 N--CA 1.469 0.507 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 79.0 m80 -135.05 179.97 5.99 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.234 1.013 . . . . 0.0 110.13 -178.329 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.409 ' SD ' ' N ' ' A' ' 3' ' ' MET . 1.0 OUTLIER -96.94 93.71 1.52 Allowed Pre-proline 0 CA--C 1.548 0.879 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 168.594 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -86.99 11.4 3.27 Favored 'Trans proline' 0 C--N 1.375 1.957 0 C-N-CA 122.848 2.365 . . . . 0.0 113.615 -170.508 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 87.6 m -145.67 -82.53 0.14 Allowed 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 123.631 0.772 . . . . 0.0 109.604 178.851 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 74.3 m -164.4 171.58 14.54 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 124.468 1.107 . . . . 0.0 109.715 -176.533 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 64.45 -178.08 0.17 Allowed 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 124.823 1.249 . . . . 0.0 113.868 168.014 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -116.59 -163.31 0.9 Allowed 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 114.268 -1.333 . . . . 0.0 109.059 175.521 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 57.85 26.8 13.69 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 123.934 0.894 . . . . 0.0 111.123 -177.246 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.567 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 59.6 mt -65.34 129.1 38.53 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 123.514 0.725 . . . . 0.0 110.577 -174.78 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 46.1 t -50.19 114.78 4.69 Favored Pre-proline 0 CA--C 1.546 0.825 0 O-C-N 124.387 1.054 . . . . 0.0 109.869 179.445 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_exo -57.55 -14.33 16.45 Favored 'Trans proline' 0 C--N 1.38 2.236 0 C-N-CA 123.352 2.701 . . . . 0.0 114.358 -172.778 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.6 mp -89.51 -42.47 14.4 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.253 0 C-N-CA 124.272 1.029 . . . . 0.0 110.047 177.507 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 79.8 m -102.12 -55.03 2.57 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.599 0.76 . . . . 0.0 112.688 -169.04 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.502 ' HA ' ' HB3' ' A' ' 10' ' ' LEU . 96.0 m-85 77.09 -32.29 0.18 Allowed 'General case' 0 N--CA 1.495 1.804 0 C-N-CA 126.318 1.847 . . . . 0.0 113.345 -178.528 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.5 -36.91 79.48 Favored 'General case' 0 N--CA 1.484 1.25 0 CA-C-N 118.564 0.62 . . . . 0.0 111.917 -179.152 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 10.9 m170 -127.07 155.14 76.42 Favored Pre-proline 0 N--CA 1.482 1.145 0 C-N-CA 124.441 1.097 . . . . 0.0 109.139 178.77 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.567 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 92.6 Cg_endo -76.91 -159.6 0.1 Allowed 'Trans proline' 0 C--N 1.376 2.023 0 C-N-CA 122.707 2.272 . . . . 0.0 113.936 179.379 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.442 HG21 ' HB3' ' A' ' 29' ' ' LYS . 83.0 mt -78.58 138.0 20.95 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.799 0 C-N-CA 124.285 1.034 . . . . 0.0 110.906 177.504 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.2 m -110.8 -27.77 8.71 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.568 0.747 . . . . 0.0 110.731 176.935 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.457 ' HB1' HG12 ' A' ' 55' ' ' VAL . . . -147.58 154.16 40.34 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.096 0.558 . . . . 0.0 111.778 -166.097 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 5.7 p -123.46 124.81 70.51 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.95 0 C-N-CA 124.552 1.141 . . . . 0.0 109.851 179.311 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -77.41 94.7 4.28 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.12 0.968 . . . . 0.0 108.97 178.55 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 -98.09 155.46 36.98 Favored Pre-proline 0 CA--C 1.546 0.823 0 C-N-CA 123.054 0.542 . . . . 0.0 111.14 -174.603 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -85.72 18.89 27.95 Favored 'Cis proline' 0 C--N 1.383 2.378 0 N-CA-C 115.049 1.134 . . . . 0.0 115.049 3.342 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 53.4 t -67.8 -65.07 0.74 Allowed 'General case' 0 C--N 1.354 0.765 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -177.901 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 124.93 -16.87 7.25 Favored Glycine 0 C--N 1.35 1.313 0 CA-C-O 119.13 -0.817 . . . . 0.0 114.211 179.5 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.569 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 21.5 m80 -63.94 149.14 47.89 Favored 'General case' 0 N--CA 1.482 1.146 0 CA-C-N 117.644 0.722 . . . . 0.0 110.206 171.987 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.442 ' HB3' HG21 ' A' ' 19' ' ' ILE . 83.1 mttt -137.22 161.58 35.82 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 123.703 0.801 . . . . 0.0 110.77 -168.324 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 38.3 t -172.98 178.65 2.48 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.847 1.259 . . . . 0.0 108.714 178.344 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 13.6 p -79.36 153.11 30.01 Favored 'General case' 0 C--O 1.246 0.9 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 173.787 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt -67.19 -23.6 65.77 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.289 0.636 . . . . 0.0 111.767 -173.353 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.51 -42.29 92.22 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.744 0.818 . . . . 0.0 111.553 177.963 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 8.7 m -56.78 -54.5 45.63 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.447 0.699 . . . . 0.0 110.851 176.429 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.531 HG12 HG21 ' A' ' 55' ' ' VAL . 9.8 tp -74.97 -23.36 17.39 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.982 0 O-C-N 123.688 0.617 . . . . 0.0 111.11 -174.67 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -62.56 -55.41 27.49 Favored 'General case' 0 N--CA 1.487 1.414 0 CA-C-O 121.505 0.669 . . . . 0.0 109.868 173.831 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 61.0 tt0 -70.44 -19.55 62.96 Favored 'General case' 0 CA--C 1.553 1.06 0 CA-C-N 114.519 -1.219 . . . . 0.0 111.063 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 62.7 t60 -81.51 -41.74 21.25 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.347 0.659 . . . . 0.0 111.367 178.685 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 48.9 mt -66.85 -24.49 66.15 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.122 0.569 . . . . 0.0 112.527 -173.445 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 27.3 ptm -69.99 -21.21 63.25 Favored 'General case' 0 N--CA 1.482 1.174 0 CA-C-O 120.576 0.226 . . . . 0.0 110.957 175.315 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 66.0 m-20 -106.02 -73.86 0.67 Allowed 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.882 0.873 . . . . 0.0 109.749 -179.041 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -111.68 -174.57 2.49 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 124.545 1.138 . . . . 0.0 110.491 -176.736 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 22.1 ttmm -139.82 15.64 2.49 Favored 'General case' 0 N--CA 1.486 1.33 0 CA-C-O 121.484 0.659 . . . . 0.0 110.665 179.63 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -88.86 164.17 15.31 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-O 121.326 0.584 . . . . 0.0 111.408 -174.469 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.569 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 43.5 t -91.66 32.87 1.05 Allowed 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 124.526 1.13 . . . . 0.0 112.664 -172.427 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 57.7 -83.46 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 125.231 1.413 . . . . 0.0 112.646 174.833 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -67.55 -24.96 65.59 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 125.505 1.522 . . . . 0.0 112.735 -167.022 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 15.2 p -131.03 -7.48 3.9 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 122.93 0.492 . . . . 0.0 111.195 -176.784 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 55.2 tttm 64.48 11.91 6.96 Favored 'General case' 0 CA--C 1.569 1.691 0 C-N-CA 124.784 1.234 . . . . 0.0 113.548 177.002 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 26.7 m -62.86 133.7 55.1 Favored 'General case' 0 N--CA 1.481 1.088 0 O-C-N 121.407 -0.808 . . . . 0.0 110.451 176.412 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 23.8 m -60.79 119.84 8.96 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.112 0.565 . . . . 0.0 110.323 179.385 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.483 HG21 HG22 ' A' ' 55' ' ' VAL . 46.6 mt -79.54 122.2 34.29 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 O-C-N 123.454 0.471 . . . . 0.0 109.754 -179.68 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 46.2 t -81.53 -38.53 16.3 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 C-N-CA 123.208 0.603 . . . . 0.0 109.553 175.846 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 34.2 p -168.11 136.97 2.41 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.706 0.803 . . . . 0.0 110.713 175.615 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.531 HG21 HG12 ' A' ' 35' ' ' ILE . 21.7 t -96.72 113.56 31.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 123.87 0.868 . . . . 0.0 109.254 178.064 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.1 mm-40 -85.24 172.86 10.82 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 110.073 -0.343 . . . . 0.0 110.073 175.313 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -87.52 135.56 33.3 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 174.212 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 73.4 t90 -117.78 120.84 39.15 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 175.698 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -138.57 141.75 39.24 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.416 1.086 . . . . 0.0 109.431 178.897 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 59.5 mtmt -80.6 79.37 7.23 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-O 121.501 0.667 . . . . 0.0 109.402 172.945 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.664 -1.075 . . . . 0.0 110.88 -176.671 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 46.3 t . . . . . 0 N--CA 1.482 1.172 0 CA-C-O 120.961 0.41 . . . . 0.0 110.212 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 50.9 m-70 -103.8 -10.54 18.18 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.283 1.033 . . . . 0.0 110.265 178.713 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 22.2 ttt -104.74 104.93 48.54 Favored Pre-proline 0 CA--C 1.556 1.204 0 C-N-CA 124.162 0.985 . . . . 0.0 108.945 -178.77 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -85.23 59.56 5.3 Favored 'Trans proline' 0 C--N 1.378 2.119 0 C-N-CA 123.317 2.678 . . . . 0.0 112.896 -176.137 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 13.7 m -64.89 114.44 4.52 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.088 0.955 . . . . 0.0 111.645 -174.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.3 t -152.34 92.55 1.7 Allowed 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.303 0.641 . . . . 0.0 109.564 -178.868 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.416 ' HG3' HD12 ' A' ' 10' ' ' LEU . 3.6 mp0 -75.43 133.95 41.01 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.993 176.334 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -112.97 38.12 2.92 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 108.328 -0.989 . . . . 0.0 108.328 168.497 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.472 ' HB3' HD12 ' A' ' 19' ' ' ILE . 13.9 m-20 75.17 77.37 0.1 Allowed 'General case' 0 C--N 1.359 1.016 0 C-N-CA 126.476 1.911 . . . . 0.0 109.525 -167.697 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.611 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 93.3 mt -93.5 157.89 15.98 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 114.65 -1.159 . . . . 0.0 110.617 178.766 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.463 ' HB3' ' HB2' ' A' ' 14' ' ' CYS . 42.4 t -66.74 116.42 34.77 Favored Pre-proline 0 CA--C 1.552 1.041 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 175.468 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_endo -58.23 -17.28 31.78 Favored 'Trans proline' 0 C--N 1.382 2.321 0 C-N-CA 123.417 2.745 . . . . 0.0 114.119 -174.683 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 73.3 mt -88.17 -45.88 15.81 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.885 0 C-N-CA 123.882 0.873 . . . . 0.0 110.788 176.544 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.463 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . 86.3 m -90.76 -55.58 3.51 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.126 0.57 . . . . 0.0 111.73 -167.861 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 84.3 m-85 74.84 -43.32 0.52 Allowed 'General case' 0 N--CA 1.494 1.743 0 C-N-CA 126.285 1.834 . . . . 0.0 111.872 -174.426 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.3 -30.6 71.26 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 124.004 0.921 . . . . 0.0 112.372 -178.752 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 21.7 m-70 -124.4 151.23 66.35 Favored Pre-proline 0 N--CA 1.479 1.016 0 C-N-CA 124.047 0.939 . . . . 0.0 109.521 176.998 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.611 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 13.1 Cg_exo -71.36 -164.55 0.16 Allowed 'Trans proline' 0 C--N 1.381 2.259 0 C-N-CA 123.898 3.066 . . . . 0.0 114.086 -177.075 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.472 HD12 ' HB3' ' A' ' 9' ' ' ASP . 83.2 mt -86.51 129.93 37.52 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.84 0 C-N-CA 123.466 0.706 . . . . 0.0 110.065 175.726 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 25.8 t -132.46 6.44 4.11 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 123.876 0.87 . . . . 0.0 110.875 178.733 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -154.95 160.93 41.48 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-O 121.343 0.592 . . . . 0.0 111.413 -178.279 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 4.7 p -145.71 139.76 21.52 Favored 'Isoleucine or valine' 0 C--O 1.244 0.781 0 C-N-CA 124.863 1.265 . . . . 0.0 108.752 177.923 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -96.79 88.11 4.5 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 178.125 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 16.1 mt-30 -84.95 149.41 53.24 Favored Pre-proline 0 C--O 1.242 0.704 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.359 -176.407 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -92.29 22.38 29.34 Favored 'Cis proline' 0 C--N 1.383 2.368 0 N-CA-C 114.776 1.029 . . . . 0.0 114.776 2.209 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 35.3 t -69.13 -50.12 50.85 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 122.767 0.427 . . . . 0.0 111.555 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 105.58 -6.08 41.23 Favored Glycine 0 C--N 1.343 0.96 0 CA-C-O 118.967 -0.907 . . . . 0.0 114.619 177.867 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.437 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 3.8 m170 -62.99 128.14 34.47 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 117.662 0.731 . . . . 0.0 110.016 173.958 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -101.21 156.82 17.21 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.219 1.008 . . . . 0.0 110.897 -174.049 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 79.9 p -168.72 -157.34 0.19 Allowed 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.415 1.086 . . . . 0.0 108.257 175.176 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 30.8 p -116.44 161.19 19.46 Favored 'General case' 0 C--O 1.247 0.964 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 170.179 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 57.5 mtpt -57.07 -40.17 76.39 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 123.494 0.718 . . . . 0.0 111.12 -179.295 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -53.83 -42.13 68.12 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 123.918 0.887 . . . . 0.0 113.086 179.197 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 8.7 m -60.32 -56.63 19.1 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.653 0.781 . . . . 0.0 111.274 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.422 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 8.6 tp -72.92 -35.36 48.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.519 -171.901 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -61.29 -47.45 85.91 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.207 0.603 . . . . 0.0 111.279 177.96 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 37.0 tt0 -62.94 -34.38 77.35 Favored 'General case' 0 CA--C 1.554 1.102 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.657 176.958 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 84.8 t60 -73.56 -37.51 65.52 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.274 1.03 . . . . 0.0 112.477 -178.334 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 77.8 mt -64.6 -17.56 64.11 Favored 'General case' 0 N--CA 1.492 1.644 0 C-N-CA 123.505 0.722 . . . . 0.0 112.569 -174.942 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 87.1 mtp -66.86 -29.16 68.99 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.297 0.639 . . . . 0.0 111.021 174.271 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 31.5 t30 -105.15 -72.89 0.69 Allowed 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 123.91 0.884 . . . . 0.0 110.269 177.998 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 79.3 m-20 -115.98 164.61 14.17 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.45 0.7 . . . . 0.0 110.783 -173.873 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -124.51 45.65 2.47 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.065 0.946 . . . . 0.0 108.93 176.804 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -109.18 168.65 9.22 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.498 177.547 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.437 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 41.6 t -93.61 32.5 1.39 Allowed 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 124.668 1.187 . . . . 0.0 111.922 -171.414 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 59.4 -84.35 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 125.616 1.566 . . . . 0.0 112.287 175.817 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 16.4 m-85 -70.6 -32.98 70.54 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.879 1.272 . . . . 0.0 112.05 -164.606 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 14.8 p -119.53 -6.2 10.24 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 122.926 0.49 . . . . 0.0 111.161 -178.109 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 55.4 mtpt 60.28 18.69 8.21 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 114.82 1.415 . . . . 0.0 114.82 178.559 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 45.6 m -62.9 137.1 58.18 Favored 'General case' 0 N--CA 1.48 1.053 0 CA-C-N 118.173 0.442 . . . . 0.0 109.936 174.081 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 29.0 m -58.15 129.64 42.93 Favored 'General case' 0 C--O 1.246 0.9 0 C-N-CA 123.24 0.616 . . . . 0.0 110.331 177.69 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 41.9 mm -66.64 102.01 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.814 0 O-C-N 123.724 0.64 . . . . 0.0 109.724 179.046 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 97.7 t -73.16 -37.69 53.17 Favored 'Isoleucine or valine' 0 C--O 1.242 0.687 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 172.071 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.8 p -158.57 133.21 8.17 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.455 174.521 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 48.5 t -90.37 116.99 32.75 Favored 'Isoleucine or valine' 0 C--N 1.353 0.73 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 163.901 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -122.63 135.55 54.64 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 177.915 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -60.92 159.16 11.81 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.665 0.786 . . . . 0.0 110.201 173.344 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 37.3 t90 -146.63 140.81 26.3 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 -177.138 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -129.15 146.92 50.98 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.849 0.86 . . . . 0.0 110.494 -172.921 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.458 ' HE2' ' HB2' ' A' ' 9' ' ' ASP . 35.0 mmtp -72.89 -41.26 64.82 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 123.662 0.785 . . . . 0.0 110.13 172.914 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.326 0 CA-C-O 118.963 -0.909 . . . . 0.0 110.841 -179.939 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 34.9 p . . . . . 0 N--CA 1.471 0.618 0 N-CA-C 110.315 -0.254 . . . . 0.0 110.315 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 9.4 p80 -110.24 166.39 11.0 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 172.197 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 26.7 ttt 61.96 90.48 0.09 OUTLIER Pre-proline 0 CA--C 1.556 1.197 0 C-N-CA 124.44 1.096 . . . . 0.0 111.504 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -80.32 93.51 1.04 Allowed 'Trans proline' 0 C--N 1.368 1.556 0 C-N-CA 122.68 2.254 . . . . 0.0 110.012 174.415 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 74.8 p -66.28 137.08 56.69 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.388 0.675 . . . . 0.0 110.131 -177.305 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 46.7 t -138.96 97.75 3.38 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 123.835 0.854 . . . . 0.0 110.825 -174.094 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -86.11 99.67 11.66 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 107.275 -1.38 . . . . 0.0 107.275 167.414 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -123.65 -178.29 3.99 Favored 'General case' 0 CA--C 1.553 1.088 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.519 -166.977 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.457 ' O ' HG13 ' A' ' 19' ' ' ILE . 4.9 m-20 -77.83 40.53 0.32 Allowed 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 124.917 1.287 . . . . 0.0 111.592 -177.616 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.511 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 74.4 mt -67.28 135.48 53.42 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.783 0.833 . . . . 0.0 112.106 -167.319 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 52.5 t -57.2 114.93 9.09 Favored Pre-proline 0 CA--C 1.55 0.952 0 O-C-N 124.308 1.005 . . . . 0.0 108.868 174.143 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -57.35 -19.84 37.13 Favored 'Trans proline' 0 N--CA 1.508 2.361 0 C-N-CA 123.373 2.716 . . . . 0.0 114.185 -175.172 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.8 mp -80.02 -26.76 12.04 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.468 0 C-N-CA 124.269 1.028 . . . . 0.0 110.774 -176.857 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 40.4 m -133.33 -42.06 0.87 Allowed 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 113.256 0.836 . . . . 0.0 113.256 -161.162 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 93.1 m-85 77.94 -37.64 0.24 Allowed 'General case' 0 N--CA 1.496 1.846 0 C-N-CA 126.248 1.819 . . . . 0.0 113.108 178.953 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -74.59 -6.95 51.44 Favored 'General case' 0 CA--C 1.555 1.156 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 -169.032 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 66.9 m-70 -141.49 137.72 16.74 Favored Pre-proline 0 N--CA 1.494 1.734 0 CA-C-N 118.658 0.663 . . . . 0.0 109.936 174.634 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.511 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 47.2 Cg_endo -88.62 80.69 0.94 Allowed 'Trans proline' 0 C--N 1.383 2.355 0 C-N-CA 123.429 2.753 . . . . 0.0 114.027 -178.725 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.457 HG13 ' O ' ' A' ' 9' ' ' ASP . 64.7 mt 63.07 155.5 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.037 0 C-N-CA 124.948 1.299 . . . . 0.0 111.957 -178.945 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.416 ' HB3' ' H ' ' A' ' 32' ' ' LYS . 26.3 t -159.81 -7.6 0.06 Allowed 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 122.696 0.398 . . . . 0.0 111.766 173.126 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -152.03 132.52 13.83 Favored 'General case' 0 N--CA 1.481 1.083 0 CA-C-N 118.348 0.522 . . . . 0.0 111.144 -175.693 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.2 p -102.41 132.89 47.53 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.88 0 C-N-CA 124.231 1.013 . . . . 0.0 109.834 173.916 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -93.71 100.11 12.39 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.118 -178.879 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 -90.02 151.47 45.14 Favored Pre-proline 0 CA--C 1.545 0.759 0 C-N-CA 123.61 0.764 . . . . 0.0 110.92 178.07 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_endo -92.44 32.21 10.7 Favored 'Cis proline' 0 C--N 1.376 2.011 0 CA-C-N 118.528 0.51 . . . . 0.0 113.112 3.436 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.7 t -83.49 -72.83 0.44 Allowed 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 122.67 0.388 . . . . 0.0 111.246 -179.826 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 133.67 -30.4 2.99 Favored Glycine 0 C--N 1.349 1.254 0 CA-C-O 119.696 -0.502 . . . . 0.0 112.674 -176.028 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 20.1 m170 -57.29 132.3 52.62 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 123.385 0.674 . . . . 0.0 110.717 175.536 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 50.3 mttp -115.52 150.66 36.2 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.152 0.981 . . . . 0.0 110.44 -175.847 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 54.5 p -142.13 -155.94 0.64 Allowed 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 166.168 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 22.3 p -99.41 162.09 13.24 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 118.312 0.506 . . . . 0.0 109.79 173.831 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.416 ' H ' ' HB3' ' A' ' 20' ' ' SER . 56.0 mtpt -63.58 -34.6 78.18 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.029 0.932 . . . . 0.0 111.282 -179.99 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.87 -32.51 70.78 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.42 0.688 . . . . 0.0 111.584 176.761 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.4 m -63.52 -55.39 24.35 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.507 0.723 . . . . 0.0 111.07 176.574 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.663 HG12 HG21 ' A' ' 55' ' ' VAL . 8.8 tp -69.75 -37.74 74.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 O-C-N 123.579 0.549 . . . . 0.0 110.95 -173.491 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -63.47 -38.44 91.15 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-O 121.134 0.492 . . . . 0.0 110.683 178.561 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -73.18 -32.69 64.98 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 123.538 0.735 . . . . 0.0 110.675 175.423 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 59.8 t60 -72.94 -32.5 65.32 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.86 0.864 . . . . 0.0 110.713 -176.948 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 97.4 mt -72.39 -7.42 49.6 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.864 0.866 . . . . 0.0 111.9 -179.072 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 92.9 mmm -74.31 -14.11 60.85 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 123.657 0.783 . . . . 0.0 110.851 168.315 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -131.37 -73.17 0.53 Allowed 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 124.131 0.972 . . . . 0.0 111.064 -175.943 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -126.79 -170.07 2.14 Favored 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 123.695 0.798 . . . . 0.0 111.177 -176.152 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -145.34 35.36 1.08 Allowed 'General case' 0 N--CA 1.476 0.825 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 176.964 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.506 ' HA ' ' HA ' ' A' ' 51' ' ' THR . 4.5 m-20 -99.16 156.82 16.76 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.144 -177.16 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.453 ' HB2' ' O ' ' A' ' 50' ' ' THR . 5.4 t -72.01 115.66 11.5 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 86.9 m-85 -49.42 -34.66 17.02 Favored 'General case' 0 N--CA 1.495 1.823 0 C-N-CA 123.989 0.916 . . . . 0.0 112.866 -177.175 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 77.6 m-85 -91.7 -28.04 17.69 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 115.2 -0.909 . . . . 0.0 112.777 -169.617 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 7.8 p -149.61 22.72 0.9 Allowed 'General case' 0 N--CA 1.496 1.857 0 N-CA-C 113.316 0.858 . . . . 0.0 113.316 -169.155 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 65.7 mttm 71.24 -28.22 0.18 Allowed 'General case' 0 N--CA 1.505 2.277 0 N-CA-C 115.671 1.73 . . . . 0.0 115.671 172.985 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.453 ' O ' ' HB2' ' A' ' 45' ' ' CYS . 7.7 m -57.43 114.25 2.13 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.75 0.82 . . . . 0.0 112.268 -169.483 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.506 ' HA ' ' HA ' ' A' ' 44' ' ' ASP . 24.8 m -57.48 123.67 16.3 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 123.369 0.668 . . . . 0.0 110.508 -179.63 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.546 HG21 HG22 ' A' ' 55' ' ' VAL . 12.2 mt -71.97 122.57 24.59 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 124.86 1.264 . . . . 0.0 109.515 -175.75 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 83.9 t -81.39 -34.31 13.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 C-N-CA 122.968 0.507 . . . . 0.0 109.842 178.43 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 24.5 t -156.29 135.7 12.28 Favored 'General case' 0 C--N 1.355 0.828 0 CA-C-O 120.935 0.397 . . . . 0.0 110.596 -179.058 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.663 HG21 HG12 ' A' ' 35' ' ' ILE . 31.6 t -108.83 106.78 21.35 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 123.682 0.793 . . . . 0.0 109.881 179.871 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -93.39 141.92 27.91 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 173.45 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -79.24 118.56 21.29 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 173.831 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 74.1 t90 -84.5 105.77 15.57 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 -175.551 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -85.71 131.98 34.23 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 170.668 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -75.28 155.51 36.61 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.332 0.653 . . . . 0.0 110.834 177.509 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.16 0 CA-C-O 118.986 -0.897 . . . . 0.0 111.156 179.001 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 40.2 m . . . . . 0 N--CA 1.482 1.148 0 CA-C-O 120.359 0.123 . . . . 0.0 111.275 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 83.9 t60 -120.81 91.21 3.48 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.356 0.662 . . . . 0.0 109.624 175.41 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 59.9 mtm -146.62 76.36 11.85 Favored Pre-proline 0 N--CA 1.477 0.896 0 C-N-CA 124.953 1.301 . . . . 0.0 107.684 167.498 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -90.42 17.96 1.41 Allowed 'Trans proline' 0 C--N 1.381 2.257 0 C-N-CA 123.144 2.563 . . . . 0.0 112.035 178.599 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 9.8 t -139.17 155.26 47.96 Favored 'General case' 0 C--O 1.245 0.818 0 C-N-CA 124.599 1.159 . . . . 0.0 109.336 -178.919 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 25.9 t -78.75 100.37 7.07 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.108 178.221 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.442 ' HG3' ' HG2' ' A' ' 8' ' ' GLU . 8.9 pt-20 -47.6 -60.97 2.17 Favored 'General case' 0 CA--C 1.554 1.127 0 C-N-CA 125.404 1.481 . . . . 0.0 114.296 -172.046 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.442 ' HG2' ' HG3' ' A' ' 7' ' ' GLU . 14.9 mm-40 -96.63 15.86 20.53 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 123.432 0.693 . . . . 0.0 110.318 -174.785 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 54.9 51.99 12.7 Favored 'General case' 0 C--N 1.353 0.742 0 CA-C-O 122.238 1.018 . . . . 0.0 109.15 -164.296 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.655 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 88.0 mt -71.71 145.83 48.58 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 113.568 -1.651 . . . . 0.0 109.716 175.827 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.613 ' SG ' ' HB2' ' A' ' 30' ' ' SER . 45.2 t -59.3 118.26 28.98 Favored Pre-proline 0 CA--C 1.548 0.899 0 CA-C-O 118.357 -0.83 . . . . 0.0 108.901 173.251 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_endo -60.55 -17.37 48.18 Favored 'Trans proline' 0 N--CA 1.507 2.3 0 C-N-CA 123.111 2.54 . . . . 0.0 112.848 -176.58 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 67.8 mt -86.53 -46.2 16.55 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.871 0 C-N-CA 124.925 1.29 . . . . 0.0 111.628 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 91.9 m -92.66 -38.39 11.88 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.253 0.621 . . . . 0.0 111.564 -170.357 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.431 ' O ' HD13 ' A' ' 10' ' ' LEU . 98.1 m-85 74.69 -44.64 0.56 Allowed 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 126.232 1.813 . . . . 0.0 112.976 179.56 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -76.76 -32.49 57.76 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.268 0.627 . . . . 0.0 112.667 -175.517 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 15.6 m-70 -112.64 153.28 45.06 Favored Pre-proline 0 N--CA 1.481 1.1 0 C-N-CA 123.875 0.87 . . . . 0.0 109.52 -175.475 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.655 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 64.6 Cg_endo -79.05 -170.89 1.1 Allowed 'Trans proline' 0 C--N 1.38 2.213 0 C-N-CA 123.124 2.549 . . . . 0.0 113.9 -174.395 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.494 HG21 ' HB3' ' A' ' 29' ' ' LYS . 97.4 mt -89.99 143.18 11.72 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 CA-C-N 114.792 -1.094 . . . . 0.0 109.968 176.841 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.6 m -142.29 13.42 2.0 Allowed 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.079 0.952 . . . . 0.0 110.841 179.698 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -155.78 136.26 13.24 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.711 0.805 . . . . 0.0 110.928 -175.588 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.7 p -122.02 126.99 75.2 Favored 'Isoleucine or valine' 0 C--O 1.24 0.564 0 C-N-CA 124.605 1.162 . . . . 0.0 108.45 172.329 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -92.98 88.65 6.22 Favored 'General case' 0 C--O 1.244 0.789 0 N-CA-C 108.133 -1.062 . . . . 0.0 108.133 -178.281 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -71.56 152.35 93.77 Favored Pre-proline 0 C--O 1.242 0.704 0 CA-C-N 114.035 -1.438 . . . . 0.0 111.863 -177.506 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_endo -92.48 28.9 15.83 Favored 'Cis proline' 0 C--N 1.375 1.955 0 C-N-CA 125.783 -0.507 . . . . 0.0 112.616 -9.43 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 53.6 t -77.24 -40.31 45.33 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.258 0.623 . . . . 0.0 111.551 -176.022 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 91.73 -6.34 79.79 Favored Glycine 0 C--N 1.343 0.942 0 CA-C-O 119.37 -0.683 . . . . 0.0 114.369 179.168 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.503 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 13.5 m170 -64.95 135.51 55.75 Favored 'General case' 0 N--CA 1.481 1.084 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 167.127 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.494 ' HB3' HG21 ' A' ' 19' ' ' ILE . 86.5 mttt -136.09 151.24 49.61 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.391 0.676 . . . . 0.0 110.644 -171.126 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.613 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 92.7 p -161.9 -173.93 3.92 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.486 1.114 . . . . 0.0 108.389 172.272 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 15.8 p -75.06 145.95 41.92 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 174.308 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -67.56 -19.81 65.32 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 122.951 0.5 . . . . 0.0 111.957 -173.456 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.78 -39.53 85.21 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 123.744 0.818 . . . . 0.0 111.536 171.408 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.8 m -61.74 -49.02 78.08 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.608 0.763 . . . . 0.0 111.721 178.364 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.516 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 9.7 tp -72.14 -36.68 57.24 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 O-C-N 123.116 0.26 . . . . 0.0 111.101 -173.36 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -64.11 -38.66 91.87 Favored 'General case' 0 CA--C 1.549 0.937 0 CA-C-O 121.126 0.488 . . . . 0.0 109.843 177.611 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.508 ' O ' ' HG2' ' A' ' 40' ' ' MET . 45.9 tt0 -69.75 -27.98 65.4 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 123.961 0.905 . . . . 0.0 110.767 173.661 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 78.3 t60 -83.59 -26.57 29.9 Favored 'General case' 0 C--O 1.21 -1.007 0 C-N-CA 123.281 0.632 . . . . 0.0 111.292 -177.303 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.575 HD22 ' HG3' ' A' ' 43' ' ' LYS . 88.0 mt -69.01 -30.77 69.24 Favored 'General case' 0 N--CA 1.486 1.338 0 CA-C-N 118.314 0.506 . . . . 0.0 111.328 -177.479 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.508 ' HG2' ' O ' ' A' ' 37' ' ' GLN . 25.1 ptt? -68.28 -21.03 64.81 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 122.402 0.281 . . . . 0.0 110.53 173.871 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 -88.3 -75.81 0.41 Allowed 'General case' 0 CA--C 1.558 1.279 0 C-N-CA 124.435 1.094 . . . . 0.0 109.412 175.34 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 48.4 m-80 -148.35 151.56 35.55 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 124.778 1.231 . . . . 0.0 109.673 178.162 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.575 ' HG3' HD22 ' A' ' 39' ' ' LEU . 13.5 mptt -90.63 62.04 5.03 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.592 0.757 . . . . 0.0 110.176 179.709 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -130.16 174.49 9.76 Favored 'General case' 0 N--CA 1.481 1.102 0 CA-C-O 121.423 0.63 . . . . 0.0 110.953 179.221 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.503 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 41.8 t -98.49 45.87 1.01 Allowed 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.63 1.172 . . . . 0.0 110.86 -172.45 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 57.39 -87.31 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 125.651 1.58 . . . . 0.0 113.031 172.092 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 73.0 m-85 -75.27 -37.34 60.97 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.923 1.289 . . . . 0.0 111.572 -165.288 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 13.8 p -110.12 -9.43 14.71 Favored 'General case' 0 N--CA 1.482 1.153 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.432 -172.372 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 99.0 mttt 60.57 30.55 19.83 Favored 'General case' 0 N--CA 1.492 1.626 0 C-N-CA 124.502 1.121 . . . . 0.0 113.74 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 74.4 m -65.97 127.64 32.89 Favored 'General case' 0 N--CA 1.481 1.117 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 169.358 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 9.0 m -59.57 123.19 16.07 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 109.611 -0.515 . . . . 0.0 109.611 176.79 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 36.4 mm -59.51 105.7 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.929 0 O-C-N 123.757 0.661 . . . . 0.0 110.725 -176.847 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 35.4 t -79.28 -46.08 23.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 175.474 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 30.0 p -160.24 138.78 10.31 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.171 0.588 . . . . 0.0 111.071 176.896 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.5 HG11 HG21 ' A' ' 35' ' ' ILE . 65.4 t -106.66 108.5 25.31 Favored 'Isoleucine or valine' 0 C--O 1.243 0.722 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 170.564 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -104.12 147.38 27.49 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 123.322 0.649 . . . . 0.0 109.798 178.657 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -69.46 96.8 0.93 Allowed 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 178.043 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 63.4 t90 -72.43 110.44 6.83 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 -178.894 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -80.32 143.72 33.37 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 115.006 -0.997 . . . . 0.0 109.348 173.267 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.89 3.34 33.61 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 124.014 0.925 . . . . 0.0 111.266 -179.737 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.22 0 CA-C-O 119.534 -0.592 . . . . 0.0 112.164 -176.564 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.675 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 93.8 mt . . . . . 0 CA--C 1.539 0.532 0 CA-C-O 120.355 0.121 . . . . 0.0 110.903 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.525 ' SG ' ' HB2' ' A' ' 30' ' ' SER . 42.0 t -49.71 111.62 2.16 Favored Pre-proline 0 CA--C 1.547 0.862 0 C-N-CA 124.753 1.221 . . . . 0.0 110.211 179.589 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -62.44 -21.41 72.72 Favored 'Trans proline' 0 C--N 1.378 2.089 0 C-N-CA 123.22 2.614 . . . . 0.0 113.661 -171.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 64.9 mt -68.41 -27.54 37.07 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.153 0 C-N-CA 124.064 0.946 . . . . 0.0 111.411 176.573 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 64.6 m -125.75 -32.85 2.8 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 -164.215 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 68.03 -47.02 0.52 Allowed 'General case' 0 N--CA 1.495 1.799 0 C-N-CA 125.807 1.643 . . . . 0.0 114.068 -173.006 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -66.52 -37.76 85.73 Favored 'General case' 0 CA--C 1.55 0.946 0 N-CA-C 113.677 0.991 . . . . 0.0 113.677 -168.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 20.8 m-70 -118.77 150.88 49.25 Favored Pre-proline 0 N--CA 1.491 1.6 0 C-N-CA 123.58 0.752 . . . . 0.0 109.85 -176.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.675 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 43.9 Cg_endo -84.26 -173.35 1.51 Allowed 'Trans proline' 0 C--N 1.379 2.134 0 C-N-CA 123.042 2.495 . . . . 0.0 113.42 -178.116 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 82.8 mt -80.31 142.54 13.76 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.794 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.349 176.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.487 ' HB3' ' HG3' ' A' ' 32' ' ' LYS . 23.1 t -150.17 -4.01 0.36 Allowed 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 123.236 0.614 . . . . 0.0 111.692 177.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -137.64 132.4 32.93 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.017 0.527 . . . . 0.0 110.725 -175.104 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 12.9 p -106.05 145.85 13.47 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 C-N-CA 124.621 1.168 . . . . 0.0 109.6 174.029 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 19.7 m-85 -112.59 88.27 2.78 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.694 0.798 . . . . 0.0 109.496 -175.304 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 51.0 mt-30 -75.82 155.83 84.81 Favored Pre-proline 0 C--O 1.243 0.737 0 C-N-CA 124.078 0.951 . . . . 0.0 111.824 -176.531 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -82.32 2.21 50.62 Favored 'Cis proline' 0 N--CA 1.508 2.333 0 N-CA-C 114.585 0.956 . . . . 0.0 114.585 -2.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 41.5 t -64.44 -49.65 70.62 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.303 0.641 . . . . 0.0 112.308 -177.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 101.65 -3.1 53.14 Favored Glycine 0 CA--C 1.529 0.955 0 CA-C-O 118.47 -1.183 . . . . 0.0 114.691 178.196 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.604 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 4.4 m170 -62.74 145.04 55.75 Favored 'General case' 0 N--CA 1.492 1.67 0 CA-C-N 118.493 1.146 . . . . 0.0 110.01 175.569 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 50.8 mttp -133.34 147.91 51.85 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 122.738 0.415 . . . . 0.0 111.254 -169.254 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.525 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 88.1 p -161.19 -169.7 2.42 Favored 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 124.105 0.962 . . . . 0.0 108.971 174.045 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 17.7 p -74.42 151.96 39.56 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 122.561 0.345 . . . . 0.0 110.372 177.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.487 ' HG3' ' HB3' ' A' ' 20' ' ' SER . 28.0 mtpp -58.69 -37.77 76.8 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.141 0.576 . . . . 0.0 111.439 179.057 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -58.3 -28.64 65.2 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.51 0.724 . . . . 0.0 112.68 178.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.2 m -59.54 -62.15 2.09 Favored 'General case' 0 N--CA 1.483 1.18 0 O-C-N 123.747 0.655 . . . . 0.0 110.89 177.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.687 HG12 HG21 ' A' ' 55' ' ' VAL . 7.3 tp -66.76 -41.06 87.38 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 O-C-N 123.8 0.688 . . . . 0.0 111.447 -172.371 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -58.53 -43.65 89.3 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 122.808 0.443 . . . . 0.0 110.816 179.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -71.77 -34.84 69.8 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.39 0.676 . . . . 0.0 109.893 176.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 74.9 t60 -70.98 -28.57 64.54 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.288 1.035 . . . . 0.0 111.097 -176.47 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 94.7 mt -70.61 -11.25 60.82 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.426 0.69 . . . . 0.0 111.632 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 30.8 mmt -82.15 -14.27 55.94 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.941 0.896 . . . . 0.0 110.931 172.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 -116.09 -74.19 0.62 Allowed 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.699 1.2 . . . . 0.0 109.783 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 79.0 m-20 -125.28 -168.09 1.78 Allowed 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 124.528 1.131 . . . . 0.0 110.9 -176.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -134.66 24.59 3.7 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 124.312 1.045 . . . . 0.0 109.512 171.291 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -87.57 165.1 15.71 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-O 121.326 0.584 . . . . 0.0 111.85 -175.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.604 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 43.5 t -94.19 36.15 1.15 Allowed 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.813 1.245 . . . . 0.0 112.086 -169.557 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 54.16 -82.39 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 125.429 1.492 . . . . 0.0 113.197 169.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 41.6 m-85 -70.71 -11.99 61.28 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.119 1.368 . . . . 0.0 113.071 -169.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 15.3 p -143.14 -7.13 0.81 Allowed 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 122.87 0.468 . . . . 0.0 111.638 178.395 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 52.1 tttm 63.03 22.79 13.65 Favored 'General case' 0 CA--C 1.569 1.676 0 C-N-CA 124.496 1.118 . . . . 0.0 113.124 176.292 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 56.0 m -73.13 151.84 41.42 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.216 0.607 . . . . 0.0 110.625 174.173 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 56.6 m -63.43 120.5 11.77 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 122.605 0.362 . . . . 0.0 110.373 174.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.48 HG21 HG22 ' A' ' 55' ' ' VAL . 49.5 mt -79.9 111.38 16.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 172.681 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 87.2 t -75.57 -46.04 37.89 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 O-C-N 123.452 0.47 . . . . 0.0 109.75 176.587 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.5 m -141.91 134.4 28.16 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 122.828 0.451 . . . . 0.0 110.677 -179.268 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.687 HG21 HG12 ' A' ' 35' ' ' ILE . 41.6 t -102.3 104.12 16.01 Favored 'Isoleucine or valine' 0 C--O 1.244 0.781 0 C-N-CA 123.776 0.831 . . . . 0.0 108.888 172.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 52.8 mm-40 -105.0 156.78 17.72 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 109.843 -0.429 . . . . 0.0 109.843 179.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -78.79 108.11 11.99 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.319 175.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 53.2 t90 . . . . . 0 CA--C 1.542 0.648 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 175.346 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.703 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 58.9 mt . . . . . 0 N--CA 1.47 0.535 0 CA-C-O 121.047 0.451 . . . . 0.0 111.856 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 42.6 t -61.33 118.98 42.12 Favored Pre-proline 0 CA--C 1.549 0.936 0 CA-C-N 115.041 -0.981 . . . . 0.0 109.705 177.19 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -71.07 -3.58 13.14 Favored 'Trans proline' 0 C--N 1.379 2.182 0 C-N-CA 123.082 2.521 . . . . 0.0 113.498 -175.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 61.1 mt -91.95 -22.69 5.95 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.311 0 C-N-CA 124.367 1.067 . . . . 0.0 110.529 177.376 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 71.2 m -124.75 -51.38 1.71 Allowed 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.257 0.623 . . . . 0.0 112.073 -167.033 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 90.8 m-85 71.69 -8.83 1.02 Allowed 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 125.669 1.588 . . . . 0.0 113.587 179.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -100.4 -14.22 18.42 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 118.962 0.801 . . . . 0.0 111.513 179.022 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 85.2 m-70 -138.68 149.45 62.37 Favored Pre-proline 0 N--CA 1.485 1.296 0 C-N-CA 123.403 0.681 . . . . 0.0 109.74 177.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.703 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 64.2 Cg_endo -68.95 174.33 8.95 Favored 'Trans proline' 0 C--N 1.383 2.392 0 C-N-CA 123.422 2.748 . . . . 0.0 114.572 -177.429 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 73.2 mt -72.7 127.78 34.98 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 N-CA-C 107.718 -1.215 . . . . 0.0 107.718 167.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 51.5 p -142.65 15.27 1.97 Allowed 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.191 0.596 . . . . 0.0 111.531 -174.358 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -154.82 149.34 26.32 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.544 0.738 . . . . 0.0 110.242 -176.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.7 p -140.69 126.53 20.23 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 175.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -87.16 104.73 16.64 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.905 0.882 . . . . 0.0 109.429 -172.513 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -100.63 142.91 25.53 Favored Pre-proline 0 CA--C 1.556 1.186 0 C-N-CA 123.972 0.909 . . . . 0.0 109.587 -175.009 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.46 ' HD3' ' HB ' ' A' ' 53' ' ' VAL . 85.8 Cg_endo -96.31 89.88 0.12 OUTLIER 'Cis proline' 0 C--N 1.382 2.29 0 CA-C-N 120.073 1.062 . . . . 0.0 112.411 -1.764 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 47.8 t -142.95 -39.84 0.33 Allowed 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 116.095 -0.502 . . . . 0.0 112.056 173.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 100.88 -16.28 57.55 Favored Glycine 0 C--N 1.349 1.269 0 CA-C-O 118.96 -0.911 . . . . 0.0 114.339 175.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.584 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 11.6 m170 -59.77 134.18 56.79 Favored 'General case' 0 N--CA 1.489 1.507 0 CA-C-N 117.789 0.795 . . . . 0.0 110.266 174.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -116.57 160.23 20.96 Favored 'General case' 0 C--O 1.238 0.471 0 C-N-CA 123.814 0.846 . . . . 0.0 111.039 -173.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 45.2 t -174.4 -176.19 1.06 Allowed 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.292 1.437 . . . . 0.0 108.57 -177.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 16.1 p -89.75 151.4 21.85 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 173.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.1 -25.16 67.97 Favored 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -178.269 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.2 -41.55 88.82 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.489 0.716 . . . . 0.0 111.499 174.491 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.7 m -56.87 -56.6 19.5 Favored 'General case' 0 N--CA 1.477 0.92 0 O-C-N 124.255 0.972 . . . . 0.0 111.109 178.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.541 HG12 HG21 ' A' ' 55' ' ' VAL . 8.0 tp -69.41 -38.97 78.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 O-C-N 123.578 0.549 . . . . 0.0 110.8 -171.624 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 86.6 m-20 -62.93 -37.64 87.83 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 122.728 0.411 . . . . 0.0 110.992 176.563 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 63.8 tt0 -70.81 -34.17 71.45 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.187 0.595 . . . . 0.0 110.737 175.422 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 33.0 t60 -70.21 -34.71 73.24 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.743 0.817 . . . . 0.0 109.936 179.123 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 98.1 mt -72.83 -7.53 51.22 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.956 0.902 . . . . 0.0 111.798 -179.3 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 94.1 mmm -79.26 -16.96 55.63 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.47 0.708 . . . . 0.0 110.809 170.299 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 64.9 m-20 -116.9 -73.58 0.64 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.814 0.846 . . . . 0.0 109.644 -179.031 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -125.39 -167.26 1.66 Allowed 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 124.718 1.207 . . . . 0.0 110.328 -175.712 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 89.0 tttt -142.13 81.46 1.75 Allowed 'General case' 0 N--CA 1.476 0.866 0 CA-C-O 121.393 0.616 . . . . 0.0 109.808 178.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.45 ' HB3' ' HA ' ' A' ' 49' ' ' LYS . 15.2 m-20 -136.1 166.26 23.8 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-O 121.946 0.879 . . . . 0.0 110.89 -173.735 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.584 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 41.9 t -92.9 29.68 1.76 Allowed 'General case' 0 N--CA 1.48 1.034 0 CA-C-N 113.818 -1.537 . . . . 0.0 110.564 178.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 63.4 -85.69 0.02 OUTLIER 'General case' 0 C--N 1.358 0.953 0 C-N-CA 125.197 1.399 . . . . 0.0 112.698 172.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 43.8 m-85 -64.2 -51.82 61.88 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.579 1.152 . . . . 0.0 111.014 -166.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 20.2 p -93.19 -11.8 31.85 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.561 -178.351 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.45 ' HA ' ' HB3' ' A' ' 44' ' ' ASP . 0.1 OUTLIER 61.21 27.51 17.24 Favored 'General case' 0 N--CA 1.495 1.797 0 C-N-CA 124.987 1.315 . . . . 0.0 113.26 -176.452 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 85.5 m -65.42 118.91 10.08 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.039 0.535 . . . . 0.0 109.625 169.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 85.3 m -56.1 129.29 39.36 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.313 0.645 . . . . 0.0 110.528 179.218 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.425 HG13 HD11 ' A' ' 35' ' ' ILE . 40.2 mm -63.7 126.09 21.61 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.775 0 C-N-CA 122.971 0.508 . . . . 0.0 111.48 -174.642 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.46 ' HB ' ' HD3' ' A' ' 25' ' ' PRO . 60.9 t -97.67 -42.9 11.9 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 169.434 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.1 t -153.9 151.95 30.05 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.927 0.891 . . . . 0.0 110.255 177.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.541 HG21 HG12 ' A' ' 35' ' ' ILE . 43.1 t -124.5 122.44 63.9 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 169.83 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -93.04 150.98 20.15 Favored 'General case' 0 C--O 1.242 0.671 0 C-N-CA 122.881 0.472 . . . . 0.0 110.679 179.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -76.02 95.85 3.68 Favored 'General case' 0 C--O 1.242 0.704 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 172.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 61.4 t90 . . . . . 0 CA--C 1.54 0.584 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 -177.823 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.589 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 96.9 mt . . . . . 0 C--O 1.235 0.319 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.549 ' SG ' ' HB2' ' A' ' 30' ' ' SER . 47.5 t -62.58 113.22 8.29 Favored Pre-proline 0 CA--C 1.538 0.486 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 169.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -58.73 -20.29 50.43 Favored 'Trans proline' 0 C--N 1.373 1.821 0 C-N-CA 122.921 2.414 . . . . 0.0 113.894 -172.07 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.8 mp -80.93 -49.7 17.89 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.159 0 C-N-CA 123.686 0.795 . . . . 0.0 110.393 176.364 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 95.8 m -79.84 -47.57 14.93 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.23 0.612 . . . . 0.0 112.469 -170.179 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 74.66 -37.96 0.37 Allowed 'General case' 0 N--CA 1.497 1.878 0 C-N-CA 126.076 1.751 . . . . 0.0 113.14 -174.592 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -91.2 0.47 57.52 Favored 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 112.914 0.709 . . . . 0.0 112.914 -175.357 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 92.1 m-70 -146.63 151.33 42.58 Favored Pre-proline 0 N--CA 1.49 1.539 0 C-N-CA 123.833 0.853 . . . . 0.0 108.812 177.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.589 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 78.7 Cg_endo -77.49 -169.8 0.82 Allowed 'Trans proline' 0 C--N 1.378 2.087 0 C-N-CA 123.528 2.819 . . . . 0.0 114.275 -175.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 84.8 mt -85.94 155.12 3.42 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.346 0 C-N-CA 124.685 1.194 . . . . 0.0 110.732 177.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 34.8 t -141.56 -10.96 0.92 Allowed 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 124.049 0.94 . . . . 0.0 111.511 177.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -149.94 146.73 27.22 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.094 0.558 . . . . 0.0 111.605 -170.453 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.6 p -111.66 141.03 28.34 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 124.293 1.037 . . . . 0.0 110.22 175.011 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.47 ' HZ ' ' HG ' ' A' ' 30' ' ' SER . 17.7 m-85 -97.72 96.16 8.06 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.647 0.779 . . . . 0.0 108.957 176.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 36.3 mt-30 -90.26 148.83 40.06 Favored Pre-proline 0 CA--C 1.543 0.698 0 C-N-CA 123.344 0.658 . . . . 0.0 110.983 -179.273 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -88.18 13.92 50.0 Favored 'Cis proline' 0 C--N 1.38 2.197 0 N-CA-C 114.606 0.964 . . . . 0.0 114.606 4.473 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 52.2 t -67.08 -70.41 0.25 Allowed 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -173.025 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 130.4 -24.2 4.45 Favored Glycine 0 C--N 1.347 1.172 0 CA-C-O 119.487 -0.618 . . . . 0.0 113.052 -177.096 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.565 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 25.6 m170 -61.29 145.77 50.26 Favored 'General case' 0 N--CA 1.486 1.363 0 CA-C-N 117.427 0.613 . . . . 0.0 110.168 171.546 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 60.4 mttp -136.82 161.32 36.32 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.404 0.682 . . . . 0.0 111.001 -171.127 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.549 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 51.3 p -165.41 -174.47 3.19 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.201 1.0 . . . . 0.0 108.99 173.153 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 17.4 p -79.17 156.35 28.25 Favored 'General case' 0 C--O 1.246 0.898 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 173.133 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -64.41 -26.61 68.53 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.302 0.641 . . . . 0.0 112.302 -177.563 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.37 -35.35 77.21 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.063 0.545 . . . . 0.0 111.937 176.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 17.6 m -69.28 -43.73 73.3 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.306 0.642 . . . . 0.0 111.564 179.031 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.548 HG12 HG21 ' A' ' 55' ' ' VAL . 9.8 tp -75.96 -31.73 22.43 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 CA-C-O 119.662 -0.209 . . . . 0.0 110.928 -177.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 58.6 t30 -61.25 -44.81 96.63 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 174.106 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 42.6 tt0 -58.46 -44.0 89.11 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 124.76 1.224 . . . . 0.0 110.907 173.004 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 49.4 t60 -71.69 -35.22 70.19 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.492 -172.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.436 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 90.6 mt -69.61 -11.91 61.21 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.397 0.679 . . . . 0.0 112.126 -178.267 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 19.3 mmt -78.56 -14.89 59.11 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 123.87 0.868 . . . . 0.0 110.585 173.016 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 21.1 m-80 -115.98 -75.84 0.58 Allowed 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.505 1.122 . . . . 0.0 109.416 -178.213 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 49.4 m-80 -132.22 -170.93 2.52 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 124.319 1.047 . . . . 0.0 110.01 -176.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -132.68 29.41 4.18 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 123.379 0.672 . . . . 0.0 110.025 177.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.424 ' HA ' ' HA ' ' A' ' 51' ' ' THR . 23.8 m-20 -89.76 161.11 16.21 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.748 0.819 . . . . 0.0 110.992 178.477 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.565 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 40.8 t -91.7 60.43 3.97 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.195 0.598 . . . . 0.0 111.762 -175.58 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 36.0 m-85 47.71 -90.84 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 126.183 1.793 . . . . 0.0 113.922 168.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 -73.51 -56.84 4.51 Favored 'General case' 0 C--N 1.354 0.804 0 C-N-CA 123.775 0.83 . . . . 0.0 110.879 -169.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 13.1 p -77.83 -20.39 53.24 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.857 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 1.2 tmtp? 69.29 1.46 3.27 Favored 'General case' 0 CA--C 1.564 1.514 0 C-N-CA 125.133 1.373 . . . . 0.0 113.433 176.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 29.1 m -56.79 120.98 8.78 Favored 'General case' 0 CA--C 1.551 1.006 0 O-C-N 121.593 -0.692 . . . . 0.0 110.041 175.438 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.424 ' HA ' ' HA ' ' A' ' 44' ' ' ASP . 21.4 m -59.98 129.25 40.87 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.16 0.584 . . . . 0.0 111.053 -174.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.526 HG21 HG22 ' A' ' 55' ' ' VAL . 17.1 mt -81.62 127.75 39.31 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 C-N-CA 124.052 0.941 . . . . 0.0 109.552 -175.129 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 78.0 t -74.97 -50.61 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 N-CA-C 109.273 -0.639 . . . . 0.0 109.273 173.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 33.0 t -147.4 134.67 20.6 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.214 -179.3 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.548 HG21 HG12 ' A' ' 35' ' ' ILE . 44.2 t -98.87 103.03 14.19 Favored 'Isoleucine or valine' 0 C--O 1.239 0.526 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 175.073 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -91.91 169.17 10.89 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 177.091 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -82.49 150.28 27.1 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 170.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 81.6 t90 . . . . . 0 C--O 1.243 0.756 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 173.653 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.675 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 96.6 mt . . . . . 0 C--O 1.237 0.399 0 CA-C-O 120.52 0.2 . . . . 0.0 110.471 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 35.4 t -61.74 116.34 20.39 Favored Pre-proline 0 CA--C 1.545 0.762 0 O-C-N 124.032 0.832 . . . . 0.0 108.952 172.436 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -64.95 -7.66 15.82 Favored 'Trans proline' 0 C--N 1.373 1.849 0 C-N-CA 123.029 2.486 . . . . 0.0 113.476 -172.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.3 mp -90.93 -54.09 7.97 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.151 0 C-N-CA 124.096 0.958 . . . . 0.0 109.436 172.05 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 70.7 m -83.73 -58.63 2.72 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 122.958 0.503 . . . . 0.0 112.333 -171.006 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.428 ' HA ' ' HB3' ' A' ' 10' ' ' LEU . 92.1 m-85 75.3 -36.23 0.3 Allowed 'General case' 0 N--CA 1.494 1.739 0 C-N-CA 126.243 1.817 . . . . 0.0 111.996 -170.734 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.92 -27.84 67.09 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 124.322 1.049 . . . . 0.0 112.452 178.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 42.3 m80 -135.48 154.8 78.65 Favored Pre-proline 0 CA--C 1.557 1.214 0 C-N-CA 124.345 1.058 . . . . 0.0 109.977 176.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.675 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 84.7 Cg_endo -73.98 -165.08 0.24 Allowed 'Trans proline' 0 C--N 1.378 2.125 0 C-N-CA 123.361 2.707 . . . . 0.0 114.678 -175.631 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 83.4 mt -84.09 150.24 4.17 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.0 0 C-N-CA 124.139 0.976 . . . . 0.0 110.416 175.346 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.413 ' HB2' ' H ' ' A' ' 32' ' ' LYS . 6.9 m -138.99 -26.54 0.84 Allowed 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.752 0.821 . . . . 0.0 111.317 -178.423 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -139.7 140.08 36.74 Favored 'General case' 0 C--O 1.241 0.644 0 C-N-CA 123.608 0.763 . . . . 0.0 110.386 -174.338 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.6 p -102.89 139.93 22.53 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 C-N-CA 123.923 0.889 . . . . 0.0 109.974 175.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 10.4 m-85 -88.25 88.28 7.58 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 176.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -85.1 139.68 36.78 Favored Pre-proline 0 CA--C 1.553 1.059 0 CA-C-N 115.067 -0.97 . . . . 0.0 110.208 -172.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -95.71 15.16 39.36 Favored 'Cis proline' 0 C--N 1.386 2.519 0 N-CA-C 114.853 1.059 . . . . 0.0 114.853 4.242 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 44.7 t -59.96 -59.74 4.94 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -173.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 123.71 -28.89 5.34 Favored Glycine 0 C--N 1.344 0.998 0 CA-C-O 119.299 -0.723 . . . . 0.0 113.035 -177.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.537 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 13.7 m170 -55.26 139.49 42.29 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 171.454 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 57.9 mttp -129.94 170.62 13.71 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 123.294 0.638 . . . . 0.0 110.642 -177.453 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 47.9 t -175.3 177.19 1.9 Allowed 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.846 1.258 . . . . 0.0 108.624 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 14.3 p -77.38 153.57 33.58 Favored 'General case' 0 C--O 1.25 1.13 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 172.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.413 ' H ' ' HB2' ' A' ' 20' ' ' SER . 48.4 tttm -65.25 -29.54 70.34 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 123.252 0.621 . . . . 0.0 111.334 -173.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -58.54 -43.35 89.23 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.503 0.721 . . . . 0.0 111.49 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 10.9 m -59.27 -51.8 68.42 Favored 'General case' 0 N--CA 1.479 1.021 0 O-C-N 124.029 0.831 . . . . 0.0 111.72 178.457 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.427 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 7.6 tp -73.12 -34.73 45.87 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.779 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.131 -172.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -60.7 -43.03 98.29 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 122.523 0.329 . . . . 0.0 110.246 174.106 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 7.3 tp60 -65.72 -34.84 79.14 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.835 175.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 57.9 t60 -69.21 -43.15 74.71 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.615 0.766 . . . . 0.0 110.329 -178.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 78.7 mt -66.96 -14.54 62.94 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 124.533 1.133 . . . . 0.0 112.118 -176.735 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 96.2 mmm -64.97 -16.21 63.11 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.591 0.757 . . . . 0.0 111.422 172.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -133.92 -68.25 0.57 Allowed 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.728 0.811 . . . . 0.0 110.057 174.454 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 88.1 m-20 -106.13 157.12 17.78 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 124.104 0.961 . . . . 0.0 111.088 -172.093 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.42 ' HD2' ' N ' ' A' ' 43' ' ' LYS . 9.4 mptt -115.68 25.36 10.83 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 123.213 0.605 . . . . 0.0 109.457 179.312 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 50.3 m-20 -91.73 163.15 14.18 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 115.439 -0.8 . . . . 0.0 111.841 -172.678 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.537 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 43.5 t -93.19 50.23 1.5 Allowed 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.805 0.842 . . . . 0.0 111.301 -176.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 52.44 -84.03 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 125.561 1.544 . . . . 0.0 114.233 170.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 90.9 m-85 -73.8 -62.86 1.35 Allowed 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.126 0.97 . . . . 0.0 110.901 -170.012 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 15.9 p -75.59 -18.97 59.57 Favored 'General case' 0 N--CA 1.48 1.057 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.758 179.291 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt 66.83 13.43 9.4 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 125.073 1.349 . . . . 0.0 113.934 176.778 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 29.8 m -66.78 125.15 24.96 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 176.014 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 49.1 m -60.27 121.96 13.29 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-O 120.974 0.416 . . . . 0.0 110.214 -179.174 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 38.0 mt -72.61 133.26 32.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 C-N-CA 124.517 1.127 . . . . 0.0 109.987 -174.234 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 90.8 t -77.75 -41.97 28.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 O-C-N 123.647 0.592 . . . . 0.0 109.654 177.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 77.2 p -152.78 134.54 14.63 Favored 'General case' 0 C--O 1.242 0.699 0 C-N-CA 122.76 0.424 . . . . 0.0 110.754 176.356 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 59.8 t -87.7 104.57 14.51 Favored 'Isoleucine or valine' 0 C--O 1.244 0.796 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 170.23 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -103.0 139.46 38.54 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 -172.304 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -70.85 96.15 1.23 Allowed 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.029 0.932 . . . . 0.0 109.502 -178.533 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 88.2 t90 . . . . . 0 C--O 1.24 0.595 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.768 -177.818 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.694 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 96.3 mt . . . . . 0 C--O 1.236 0.39 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 52.1 t -58.61 115.28 11.09 Favored Pre-proline 0 CA--C 1.547 0.841 0 O-C-N 124.234 0.959 . . . . 0.0 109.847 -178.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_endo -58.71 -22.22 60.06 Favored 'Trans proline' 0 N--CA 1.502 2.027 0 C-N-CA 123.141 2.561 . . . . 0.0 113.537 -174.38 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 77.3 mt -80.5 -40.03 19.14 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.338 0 C-N-CA 124.115 0.966 . . . . 0.0 111.14 178.313 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 76.5 m -102.72 -54.48 2.64 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 123.616 0.766 . . . . 0.0 111.226 -170.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.407 ' O ' HD13 ' A' ' 10' ' ' LEU . 1.7 t80 81.9 -35.87 0.1 Allowed 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 126.616 1.966 . . . . 0.0 111.719 175.36 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.01 -33.63 70.56 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.23 0.612 . . . . 0.0 111.684 179.06 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 41.3 m170 -114.1 150.18 43.18 Favored Pre-proline 0 N--CA 1.483 1.178 0 C-N-CA 123.91 0.884 . . . . 0.0 109.321 179.132 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.694 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 49.4 Cg_endo -79.26 -165.02 0.31 Allowed 'Trans proline' 0 C--N 1.378 2.111 0 C-N-CA 122.924 2.416 . . . . 0.0 113.142 -174.267 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.498 HG21 ' HB3' ' A' ' 29' ' ' LYS . 97.9 mt -86.43 145.09 8.15 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.511 0 C-N-CA 123.946 0.898 . . . . 0.0 109.217 170.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.2 m -130.41 -19.99 3.02 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.695 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -137.68 133.77 34.64 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 122.833 0.453 . . . . 0.0 111.91 -168.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.7 p -106.57 140.78 23.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 124.833 1.253 . . . . 0.0 109.418 171.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -105.47 93.86 4.9 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.07 0.548 . . . . 0.0 110.0 -171.005 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -66.81 144.04 98.36 Favored Pre-proline 0 CA--C 1.547 0.829 0 C-N-CA 123.368 0.667 . . . . 0.0 111.144 175.677 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -85.51 0.25 63.69 Favored 'Cis proline' 0 C--N 1.377 2.035 0 N-CA-C 114.216 0.814 . . . . 0.0 114.216 -1.302 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 51.1 t -64.82 -59.74 3.87 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 -168.174 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 116.73 -16.12 13.99 Favored Glycine 0 C--N 1.346 1.129 0 CA-C-O 119.084 -0.842 . . . . 0.0 114.077 -177.311 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.67 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 9.8 m170 -63.62 161.3 15.05 Favored 'General case' 0 N--CA 1.49 1.558 0 CA-C-N 117.98 0.89 . . . . 0.0 110.515 176.15 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.498 ' HB3' HG21 ' A' ' 19' ' ' ILE . 40.3 mtmt -151.35 144.8 24.85 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 115.401 -0.818 . . . . 0.0 112.615 -161.376 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 59.8 p -156.47 -178.59 7.45 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.324 1.05 . . . . 0.0 109.006 170.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 16.8 p -72.05 162.06 30.0 Favored 'General case' 0 C--O 1.247 0.96 0 C-N-CA 122.518 0.327 . . . . 0.0 110.449 178.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 32.8 ttmt -55.94 -42.55 76.33 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.316 1.046 . . . . 0.0 110.909 177.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -56.7 -44.89 81.98 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.241 1.016 . . . . 0.0 112.465 -176.257 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 32.3 m -61.72 -54.94 35.81 Favored 'General case' 0 N--CA 1.481 1.105 0 O-C-N 123.776 0.673 . . . . 0.0 110.868 179.197 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 9.0 tp -72.54 -28.02 27.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 C-N-CA 122.796 0.438 . . . . 0.0 111.762 -172.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 50.4 t-20 -66.54 -51.78 52.8 Favored 'General case' 0 N--CA 1.486 1.325 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 178.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -69.41 -26.38 64.6 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 114.946 -1.025 . . . . 0.0 111.495 177.704 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 48.4 t60 -71.33 -41.34 69.96 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.301 0.64 . . . . 0.0 110.216 178.552 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 92.8 mt -75.08 0.2 16.89 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 123.193 0.597 . . . . 0.0 112.459 -179.006 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 86.3 mtp -80.09 -35.81 36.36 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.478 0.711 . . . . 0.0 109.317 166.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -106.28 -73.5 0.68 Allowed 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.136 0.975 . . . . 0.0 110.981 -173.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 -103.06 -168.6 1.54 Allowed 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 124.345 1.058 . . . . 0.0 110.703 -175.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.408 ' HG3' HG23 ' A' ' 51' ' ' THR . 59.6 pttt -150.55 22.33 0.81 Allowed 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.54 0.736 . . . . 0.0 109.845 176.312 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -97.84 165.39 11.96 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.796 0.838 . . . . 0.0 112.093 -174.062 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.67 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 48.9 t -91.73 39.24 1.0 Allowed 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 124.001 0.921 . . . . 0.0 111.889 -171.636 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 57.05 -84.98 0.02 OUTLIER 'General case' 0 CA--C 1.559 1.314 0 C-N-CA 125.3 1.44 . . . . 0.0 113.156 172.351 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 84.0 m-85 -78.17 -60.41 2.38 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.268 1.027 . . . . 0.0 111.474 -167.275 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 14.2 p -72.13 -21.15 61.51 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-N 117.7 0.227 . . . . 0.0 110.873 178.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 8.3 tmtt? 62.01 39.13 13.61 Favored 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 124.803 1.241 . . . . 0.0 111.019 175.284 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 25.2 m -88.63 137.09 32.64 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 166.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.408 HG23 ' HG3' ' A' ' 43' ' ' LYS . 29.1 m -68.17 120.66 14.72 Favored 'General case' 0 CA--C 1.554 1.1 0 CA-C-N 118.305 0.502 . . . . 0.0 110.406 -178.706 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 55.4 mt -67.44 131.25 33.05 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 C-N-CA 123.845 0.858 . . . . 0.0 110.115 -179.606 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 93.2 t -87.58 -40.58 13.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 122.855 0.462 . . . . 0.0 110.005 175.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.1 t -152.06 140.57 20.67 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 122.742 0.417 . . . . 0.0 110.754 -178.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 41.4 t -105.95 128.96 59.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 N-CA-C 108.739 -0.838 . . . . 0.0 108.739 175.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.5 mm-40 -118.33 157.31 27.33 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.64 1.176 . . . . 0.0 109.56 178.039 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -81.88 108.7 15.61 Favored 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 174.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 61.1 t90 . . . . . 0 N--CA 1.469 0.514 0 C-N-CA 122.89 0.476 . . . . 0.0 109.744 178.29 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.679 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 41.2 mt . . . . . 0 N--CA 1.472 0.631 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 11.8 t -58.66 108.08 1.19 Allowed Pre-proline 0 CA--C 1.549 0.935 0 CA-C-O 117.903 -1.046 . . . . 0.0 109.413 168.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -65.9 -13.16 38.53 Favored 'Trans proline' 0 C--N 1.381 2.265 0 C-N-CA 123.148 2.566 . . . . 0.0 113.237 -171.751 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 55.8 mt -67.71 -23.89 30.16 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.499 0 C-N-CA 124.03 0.932 . . . . 0.0 110.902 173.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 59.4 m -131.03 -55.09 1.05 Allowed 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 124.106 0.963 . . . . 0.0 111.235 -170.015 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 26.0 t80 75.69 28.3 0.93 Allowed 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 126.104 1.762 . . . . 0.0 109.907 178.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -104.28 -51.48 3.11 Favored 'General case' 0 CA--C 1.552 1.023 0 CA-C-N 115.469 -0.787 . . . . 0.0 112.246 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 12.2 m-70 -121.93 141.62 34.49 Favored Pre-proline 0 N--CA 1.495 1.806 0 C-N-CA 123.65 0.78 . . . . 0.0 109.948 -173.631 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.679 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 45.8 Cg_endo -84.15 47.26 2.19 Favored 'Trans proline' 0 C--N 1.386 2.539 0 C-N-CA 123.717 2.945 . . . . 0.0 114.796 -171.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.465 HG21 ' HB3' ' A' ' 29' ' ' LYS . 77.6 mt 68.21 143.63 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.352 0 C-N-CA 125.164 1.386 . . . . 0.0 112.649 172.273 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.0 t -155.11 19.9 0.43 Allowed 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 122.721 0.408 . . . . 0.0 111.144 176.091 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.474 ' HB2' ' HD2' ' A' ' 32' ' ' LYS . . . -139.97 132.23 28.24 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 122.879 0.472 . . . . 0.0 109.8 176.211 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.4 p -113.24 132.98 60.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 C-N-CA 123.486 0.714 . . . . 0.0 109.236 173.066 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 14.5 m-85 -87.84 90.49 8.4 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 -178.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -73.2 136.93 78.77 Favored Pre-proline 0 CA--C 1.553 1.089 0 CA-C-N 114.136 -1.393 . . . . 0.0 109.89 -178.215 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -98.15 20.34 26.46 Favored 'Cis proline' 0 C--N 1.374 1.911 0 N-CA-C 114.595 0.96 . . . . 0.0 114.595 -3.085 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 41.5 t -62.67 -65.6 0.66 Allowed 'General case' 0 N--CA 1.482 1.126 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -175.718 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 128.86 -25.68 4.63 Favored Glycine 0 C--N 1.35 1.347 0 CA-C-O 119.553 -0.582 . . . . 0.0 113.465 -178.001 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.647 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 26.4 m80 -63.06 147.78 49.72 Favored 'General case' 0 N--CA 1.484 1.259 0 CA-C-N 117.212 0.506 . . . . 0.0 109.64 171.077 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.465 ' HB3' HG21 ' A' ' 19' ' ' ILE . 96.1 mttt -133.95 168.92 17.9 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.926 0.89 . . . . 0.0 110.41 -173.567 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 21.2 t -168.81 177.57 4.99 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.604 0.762 . . . . 0.0 110.662 177.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 12.8 p -80.45 153.74 28.05 Favored 'General case' 0 C--O 1.246 0.876 0 CA-C-N 115.573 -0.739 . . . . 0.0 109.217 175.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.474 ' HD2' ' HB2' ' A' ' 21' ' ' ALA . 14.9 mmmm -57.96 -39.68 78.73 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.801 0.84 . . . . 0.0 112.366 -172.522 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -64.65 -35.95 82.69 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.783 0.833 . . . . 0.0 112.293 -176.246 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.8 m -59.0 -56.52 21.26 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.05 0.54 . . . . 0.0 111.238 177.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 8.4 tp -76.1 -31.32 21.42 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 CA-C-N 115.483 -0.78 . . . . 0.0 111.398 -172.115 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -63.73 -40.22 96.21 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-O 121.0 0.429 . . . . 0.0 110.465 177.138 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -76.12 -35.29 59.34 Favored 'General case' 0 CA--C 1.547 0.851 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.834 176.16 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 84.5 t60 -67.4 -42.97 82.43 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.371 0.668 . . . . 0.0 110.977 -175.277 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 67.9 mt -58.89 -23.88 61.56 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 124.234 1.013 . . . . 0.0 112.573 -177.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 55.0 mtt -66.98 -32.42 73.64 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 123.515 0.726 . . . . 0.0 110.756 176.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -100.73 -67.9 0.84 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 124.278 1.031 . . . . 0.0 110.559 179.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -124.49 156.66 36.88 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 124.019 0.928 . . . . 0.0 111.479 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 32.1 mtmm -102.45 17.47 23.5 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.247 0.619 . . . . 0.0 110.213 176.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 42.0 m-20 -88.18 151.74 22.48 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.499 0.72 . . . . 0.0 112.18 -169.151 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.647 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 39.2 t -88.64 58.7 4.78 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.658 0.783 . . . . 0.0 111.408 -177.069 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 42.97 -85.93 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 126.636 1.974 . . . . 0.0 115.094 171.347 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 53.1 m-85 -73.18 -38.23 66.24 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.384 1.074 . . . . 0.0 111.426 -165.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 16.2 p -102.63 -12.65 17.56 Favored 'General case' 0 N--CA 1.483 1.201 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.506 179.355 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.411 ' HE2' ' HB2' ' A' ' 49' ' ' LYS . 1.5 mppt? 54.26 17.74 1.6 Allowed 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 125.759 1.623 . . . . 0.0 113.691 -176.397 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 31.1 m -64.91 116.26 6.2 Favored 'General case' 0 C--N 1.35 0.594 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 174.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 13.1 m -60.13 116.15 3.99 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 122.879 0.472 . . . . 0.0 110.561 -173.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.454 HG21 HG22 ' A' ' 55' ' ' VAL . 37.6 mt -66.9 127.43 28.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 C-N-CA 124.733 1.213 . . . . 0.0 110.595 -171.537 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 29.0 t -80.89 -41.72 19.77 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.585 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 47.5 t -146.35 133.48 20.43 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.4 0.68 . . . . 0.0 109.483 177.398 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.454 HG22 HG21 ' A' ' 52' ' ' ILE . 45.9 t -98.54 104.14 15.59 Favored 'Isoleucine or valine' 0 C--O 1.245 0.853 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 172.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -91.29 143.66 26.41 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 122.785 0.434 . . . . 0.0 110.251 -178.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -76.77 108.44 9.79 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 173.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 37.6 t90 . . . . . 0 CA--C 1.541 0.618 0 C-N-CA 123.79 0.836 . . . . 0.0 110.696 -176.245 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.561 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 35.4 mt . . . . . 0 CA--C 1.542 0.644 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 40.6 t -58.68 115.79 12.99 Favored Pre-proline 0 CA--C 1.549 0.937 0 CA-C-O 117.844 -1.074 . . . . 0.0 108.65 171.366 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_exo -52.56 -30.09 43.39 Favored 'Trans proline' 0 N--CA 1.506 2.212 0 C-N-CA 123.12 2.546 . . . . 0.0 114.066 -171.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.404 HD12 ' H ' ' A' ' 13' ' ' ILE . 4.2 mp -77.04 -37.72 26.86 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.072 0 C-N-CA 124.109 0.964 . . . . 0.0 110.973 -177.339 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 73.9 m -106.07 -47.34 3.86 Favored 'General case' 0 N--CA 1.485 1.28 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 -167.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.414 ' HA ' ' HB3' ' A' ' 10' ' ' LEU . 53.4 m-85 77.78 -51.89 0.52 Allowed 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 126.637 1.975 . . . . 0.0 111.638 -174.898 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.13 -5.68 14.49 Favored 'General case' 0 N--CA 1.484 1.265 0 N-CA-C 114.374 1.25 . . . . 0.0 114.374 -170.35 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 28.1 m170 -135.58 132.88 19.91 Favored Pre-proline 0 N--CA 1.483 1.218 0 C-N-CA 123.412 0.685 . . . . 0.0 109.384 172.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.561 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 42.2 Cg_endo -86.2 71.31 4.18 Favored 'Trans proline' 0 C--N 1.377 2.054 0 C-N-CA 123.46 2.773 . . . . 0.0 114.386 -173.527 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 81.9 mt 61.88 170.42 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.499 2.024 0 C-N-CA 124.27 1.028 . . . . 0.0 111.017 176.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 70.3 m -156.31 -37.91 0.08 Allowed 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 124.074 0.95 . . . . 0.0 110.188 173.337 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.413 ' HA ' ' H ' ' A' ' 58' ' ' TRP . . . -127.28 171.51 11.41 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.093 0.957 . . . . 0.0 111.24 -174.309 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 4.8 p -141.56 140.11 31.39 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 C-N-CA 124.305 1.042 . . . . 0.0 109.443 -179.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -88.3 96.4 10.56 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 124.202 1.001 . . . . 0.0 108.878 -178.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.7 tp60 -92.75 145.92 31.22 Favored Pre-proline 0 CA--C 1.555 1.137 0 CA-C-N 114.802 -1.09 . . . . 0.0 109.658 -174.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -93.59 37.53 5.92 Favored 'Cis proline' 0 C--N 1.378 2.091 0 CA-C-N 120.035 1.048 . . . . 0.0 114.431 -2.384 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 19.3 t -75.66 -78.64 0.11 Allowed 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 122.539 0.336 . . . . 0.0 111.399 176.021 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 141.44 -26.5 2.42 Favored Glycine 0 C--N 1.357 1.702 0 CA-C-O 119.724 -0.487 . . . . 0.0 113.198 -173.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.433 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 16.5 m80 -59.57 136.57 58.03 Favored 'General case' 0 N--CA 1.487 1.391 0 CA-C-N 117.144 0.472 . . . . 0.0 110.456 173.748 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -122.74 154.19 38.47 Favored 'General case' 0 C--O 1.238 0.447 0 C-N-CA 123.682 0.793 . . . . 0.0 110.445 -176.054 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 27.0 t -164.28 -168.91 1.66 Allowed 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.655 1.182 . . . . 0.0 107.842 -179.175 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 20.8 p -101.82 164.97 11.45 Favored 'General case' 0 N--CA 1.477 0.92 0 O-C-N 121.619 -0.676 . . . . 0.0 110.979 -179.465 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt -55.12 -42.84 73.47 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 124.576 1.151 . . . . 0.0 110.986 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.89 -44.84 94.01 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.743 0.817 . . . . 0.0 112.266 -177.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 7.0 m -58.57 -53.56 56.98 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 123.67 0.788 . . . . 0.0 112.195 -179.22 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 5.6 tp -70.75 -39.39 75.57 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.096 -174.22 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -61.95 -35.88 79.76 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.32 0.648 . . . . 0.0 110.858 177.488 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -73.67 -40.41 63.71 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 124.054 0.942 . . . . 0.0 110.935 176.343 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 77.2 t60 -66.61 -38.77 87.65 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.3 1.04 . . . . 0.0 111.799 -176.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 78.5 mt -62.79 -17.14 60.66 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.83 0.852 . . . . 0.0 112.91 -175.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 83.0 mtp -67.4 -31.25 71.33 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.432 0.693 . . . . 0.0 111.35 174.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 43.2 t-20 -104.38 -68.58 0.84 Allowed 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.7 m-80 -120.89 169.54 10.35 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 123.359 0.664 . . . . 0.0 111.119 -175.296 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 58.6 mmtt -111.25 10.75 21.74 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.396 0.678 . . . . 0.0 109.887 179.152 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 61.3 m-20 -85.5 163.88 18.16 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.726 0.811 . . . . 0.0 113.179 -168.766 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.433 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 42.0 t -92.75 61.14 3.55 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.467 0.707 . . . . 0.0 111.559 -176.698 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 47.37 -81.48 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 125.869 1.668 . . . . 0.0 114.298 164.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 47.7 m-85 -79.05 -46.61 17.77 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.368 1.067 . . . . 0.0 111.057 -170.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 15.5 p -100.18 -7.02 25.25 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 122.596 0.358 . . . . 0.0 111.498 -177.123 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 58.73 21.82 9.32 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 124.845 1.258 . . . . 0.0 113.623 176.149 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 29.5 m -72.91 124.77 26.1 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 174.35 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 28.5 m -60.23 115.8 3.77 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-O 120.907 0.384 . . . . 0.0 110.038 -178.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.463 HG21 HG22 ' A' ' 55' ' ' VAL . 38.7 mt -71.51 125.62 30.34 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 124.126 0.97 . . . . 0.0 110.624 -171.554 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 36.7 t -85.88 -41.47 15.32 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.774 0 C-N-CA 123.227 0.611 . . . . 0.0 109.678 -178.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 48.0 m -147.97 145.44 28.55 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.501 0.721 . . . . 0.0 110.024 178.194 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.463 HG22 HG21 ' A' ' 52' ' ' ILE . 38.3 t -115.11 104.62 17.15 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 175.4 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -88.64 144.48 26.26 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 110.065 -0.346 . . . . 0.0 110.065 179.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -73.8 103.74 4.45 Favored 'General case' 0 C--O 1.238 0.463 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 172.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' TRP . . . . . 0.413 ' H ' ' HA ' ' A' ' 21' ' ' ALA . 53.5 t90 . . . . . 0 CA--C 1.541 0.616 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 178.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.535 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 48.2 mt . . . . . 0 CA--C 1.538 0.496 0 CA-C-O 119.949 -0.072 . . . . 0.0 111.159 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 46.4 t -53.07 109.29 1.39 Allowed Pre-proline 0 C--N 1.352 0.685 0 O-C-N 124.375 1.047 . . . . 0.0 109.51 172.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -56.39 -31.05 83.94 Favored 'Trans proline' 0 C--N 1.373 1.832 0 C-N-CA 122.905 2.403 . . . . 0.0 113.376 -172.689 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 55.6 mt -66.56 -39.01 82.86 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.004 0 C-N-CA 124.262 1.025 . . . . 0.0 111.5 -179.383 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 82.5 m -106.87 -24.87 11.91 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.415 0.686 . . . . 0.0 112.68 -170.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 90.8 m-85 67.27 -60.44 0.37 Allowed 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 126.098 1.759 . . . . 0.0 112.86 -170.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.34 -44.13 92.69 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 114.791 1.404 . . . . 0.0 114.791 -165.241 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 54.4 m170 -104.37 150.84 38.88 Favored Pre-proline 0 N--CA 1.485 1.295 0 C-N-CA 123.179 0.591 . . . . 0.0 109.68 -175.571 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.535 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 84.0 Cg_endo -75.39 -164.42 0.24 Allowed 'Trans proline' 0 C--N 1.373 1.864 0 C-N-CA 123.049 2.5 . . . . 0.0 113.685 -179.063 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 97.4 mt -78.91 131.59 34.05 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.638 173.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 38.7 t -128.13 -5.84 5.5 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.188 0.995 . . . . 0.0 110.497 179.156 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -150.68 158.24 43.92 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.273 0.629 . . . . 0.0 111.309 -176.115 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.1 p -137.64 122.91 24.85 Favored 'Isoleucine or valine' 0 C--O 1.245 0.828 0 C-N-CA 124.293 1.037 . . . . 0.0 109.016 178.122 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.0 m-30 -75.23 86.09 2.44 Favored 'General case' 0 C--O 1.241 0.606 0 CA-C-N 115.167 -0.924 . . . . 0.0 108.674 178.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 11.4 mt-30 -87.83 146.47 38.96 Favored Pre-proline 0 CA--C 1.543 0.711 0 C-N-CA 122.87 0.468 . . . . 0.0 111.203 -174.513 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_endo -92.17 17.99 40.68 Favored 'Cis proline' 0 C--N 1.371 1.734 0 C-N-CA 124.859 -0.892 . . . . 0.0 114.094 3.151 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 27.4 t -72.29 -27.5 62.5 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 111.879 0.326 . . . . 0.0 111.879 -173.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 90.74 -16.85 57.21 Favored Glycine 0 C--N 1.347 1.179 0 CA-C-O 119.357 -0.69 . . . . 0.0 114.458 175.246 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 5.9 m80 -61.94 120.06 10.05 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.15 0.58 . . . . 0.0 110.26 175.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 52.5 mttp -110.13 159.47 17.32 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.563 0.697 . . . . 0.0 111.763 -174.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 93.0 p -166.37 -164.57 0.68 Allowed 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 114.183 -1.371 . . . . 0.0 107.894 173.266 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 16.3 p -86.24 154.17 21.47 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 171.015 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -67.55 -28.81 68.11 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.214 0.606 . . . . 0.0 110.239 -175.38 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -56.95 -41.54 78.45 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.766 0.826 . . . . 0.0 112.012 175.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.8 m -55.23 -59.26 5.03 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.511 0.724 . . . . 0.0 110.994 177.419 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.712 HG21 HG11 ' A' ' 55' ' ' VAL . 10.4 tp -73.79 -22.55 18.67 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.763 0 CA-C-N 115.3 -0.863 . . . . 0.0 111.599 -173.263 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -64.49 -42.26 95.97 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 122.802 0.441 . . . . 0.0 109.853 178.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 22.7 tm0? -74.69 -34.71 62.71 Favored 'General case' 0 CA--C 1.552 1.048 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.41 176.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.502 ' HB3' HD12 ' A' ' 35' ' ' ILE . 41.5 t60 -67.21 -39.93 86.36 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.829 0.852 . . . . 0.0 111.333 -177.69 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 72.7 mt -73.99 -0.89 17.66 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 123.7 0.8 . . . . 0.0 112.82 -177.333 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 64.1 mtt -72.85 -14.31 61.47 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 123.074 0.55 . . . . 0.0 111.245 174.007 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -149.41 -57.58 0.2 Allowed 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.633 0.773 . . . . 0.0 109.621 174.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 36.4 m-20 -79.68 172.59 13.58 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.914 0.886 . . . . 0.0 110.71 -175.086 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -159.69 54.18 0.37 Allowed 'General case' 0 N--CA 1.484 1.227 0 CA-C-O 122.073 0.94 . . . . 0.0 109.204 -176.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -155.14 174.27 15.43 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.21 -172.031 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 96.9 m -70.6 137.17 49.76 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.87 172.36 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 71.0 m-85 -58.43 -36.12 73.15 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-O 121.198 0.523 . . . . 0.0 109.854 167.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -76.91 -75.23 0.21 Allowed 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 124.625 1.17 . . . . 0.0 111.705 -172.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 7.2 p -91.98 -8.25 46.66 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.136 0.575 . . . . 0.0 112.368 -170.141 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 66.56 18.3 10.76 Favored 'General case' 0 CA--C 1.572 1.803 0 C-N-CA 124.287 1.035 . . . . 0.0 111.786 178.578 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 93.6 m -78.59 129.96 35.38 Favored 'General case' 0 N--CA 1.485 1.304 0 O-C-N 121.479 -0.763 . . . . 0.0 110.593 174.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 31.2 m -59.97 134.44 57.04 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.249 1.02 . . . . 0.0 111.123 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.505 HG21 HG22 ' A' ' 55' ' ' VAL . 22.0 mt -93.24 135.49 27.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 123.355 0.662 . . . . 0.0 109.94 -177.622 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 77.2 t -79.66 -46.37 22.75 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 C-N-CA 123.106 0.562 . . . . 0.0 109.549 174.223 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 47.1 p -160.33 134.71 7.42 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.035 0.534 . . . . 0.0 110.057 179.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.712 HG11 HG21 ' A' ' 35' ' ' ILE . 36.9 t -98.21 105.16 16.88 Favored 'Isoleucine or valine' 0 C--O 1.243 0.762 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 177.807 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -86.06 143.09 28.27 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 176.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -71.3 123.94 23.4 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 172.39 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 32.4 t90 . . . . . 0 C--O 1.242 0.698 0 CA-C-O 121.081 0.467 . . . . 0.0 111.102 -171.753 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.469 HD13 ' O ' ' A' ' 15' ' ' TYR . 75.2 mt . . . . . 0 N--CA 1.473 0.713 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 52.4 t -55.04 120.75 31.54 Favored Pre-proline 0 CA--C 1.555 1.155 0 CA-C-O 118.71 -0.662 . . . . 0.0 111.241 -177.263 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -58.1 -27.76 81.09 Favored 'Trans proline' 0 C--N 1.387 2.569 0 C-N-CA 123.236 2.624 . . . . 0.0 113.248 -172.785 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.5 mp -77.49 -47.15 26.76 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.939 0 CA-C-N 114.642 -1.163 . . . . 0.0 110.331 179.09 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 74.3 m -95.61 -59.15 1.93 Allowed 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.354 0.661 . . . . 0.0 111.85 -166.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.469 ' O ' HD13 ' A' ' 10' ' ' LEU . 22.6 m-85 75.19 -39.37 0.4 Allowed 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 125.72 1.608 . . . . 0.0 113.09 -172.865 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.57 -8.43 53.98 Favored 'General case' 0 N--CA 1.486 1.341 0 CA-C-N 118.812 0.733 . . . . 0.0 112.339 -179.213 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 70.0 m80 -142.09 153.54 63.69 Favored Pre-proline 0 CA--C 1.555 1.161 0 C-N-CA 124.003 0.921 . . . . 0.0 108.639 175.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -79.09 -159.63 0.11 Allowed 'Trans proline' 0 C--N 1.382 2.335 0 C-N-CA 123.289 2.659 . . . . 0.0 113.421 -177.112 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.441 HG21 ' HB3' ' A' ' 29' ' ' LYS . 53.7 mt -98.87 133.52 41.15 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 C-N-CA 124.188 0.995 . . . . 0.0 110.095 176.415 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.406 ' H ' ' HA ' ' A' ' 31' ' ' CYS . 50.1 m -137.4 18.0 2.93 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.196 0.998 . . . . 0.0 110.593 -179.491 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.421 ' HA ' ' O ' ' A' ' 56' ' ' GLU . . . -154.09 141.03 19.25 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.182 0.593 . . . . 0.0 110.747 -176.359 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 6.9 p -123.51 133.21 69.81 Favored 'Isoleucine or valine' 0 C--O 1.241 0.607 0 C-N-CA 123.522 0.729 . . . . 0.0 109.208 173.626 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -86.96 91.24 8.62 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-N 115.182 -0.917 . . . . 0.0 108.606 -179.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -83.07 141.99 43.93 Favored Pre-proline 0 CA--C 1.552 1.023 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.389 -171.36 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_endo -97.49 23.62 23.46 Favored 'Cis proline' 0 C--N 1.377 2.031 0 CA-C-N 119.369 0.81 . . . . 0.0 113.2 -1.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 43.0 t -63.34 -55.4 24.86 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.313 0.645 . . . . 0.0 111.757 -176.101 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 117.09 -25.31 8.87 Favored Glycine 0 C--N 1.345 1.074 0 CA-C-O 119.351 -0.694 . . . . 0.0 113.681 -179.356 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.436 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 19.9 m170 -58.64 141.53 52.16 Favored 'General case' 0 N--CA 1.484 1.256 0 CA-C-N 117.43 0.615 . . . . 0.0 109.566 172.087 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.441 ' HB3' HG21 ' A' ' 19' ' ' ILE . 53.9 mttp -132.63 165.09 25.23 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.004 0.522 . . . . 0.0 110.747 -174.389 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 42.9 t -172.18 -179.87 2.43 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.258 1.423 . . . . 0.0 107.909 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.406 ' HA ' ' H ' ' A' ' 20' ' ' SER . 13.9 p -78.24 150.13 33.5 Favored 'General case' 0 C--O 1.245 0.848 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 171.912 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -60.6 -38.12 83.63 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 122.922 0.489 . . . . 0.0 111.827 -175.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.41 -32.05 69.82 Favored 'General case' 0 CA--C 1.554 1.133 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -176.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.1 m -61.33 -58.43 8.28 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 123.454 0.702 . . . . 0.0 111.139 172.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.552 HG21 HG11 ' A' ' 55' ' ' VAL . 7.0 tp -69.37 -30.4 45.62 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 O-C-N 123.285 0.366 . . . . 0.0 111.295 -173.009 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 61.0 t30 -63.38 -45.7 89.9 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 175.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -65.79 -33.57 76.16 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.853 0.861 . . . . 0.0 110.509 175.018 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.472 ' HA ' HD22 ' A' ' 41' ' ' ASN . 69.9 t60 -71.42 -32.78 68.78 Favored 'General case' 0 C--O 1.217 -0.644 0 C-N-CA 123.584 0.753 . . . . 0.0 110.372 -179.342 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.519 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 90.9 mt -66.61 -9.57 36.84 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 123.629 0.772 . . . . 0.0 111.913 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 82.2 mtp -76.69 -41.74 44.24 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 122.979 0.512 . . . . 0.0 109.732 168.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.472 HD22 ' HA ' ' A' ' 38' ' ' HIS . 23.4 m-80 -76.09 -70.41 0.44 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.039 0.935 . . . . 0.0 110.294 179.412 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 -143.87 167.39 22.44 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 125.121 1.368 . . . . 0.0 109.271 -177.242 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -98.33 21.2 11.35 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-O 121.813 0.816 . . . . 0.0 110.31 175.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -90.37 166.26 13.39 Favored 'General case' 0 CA--C 1.545 0.75 0 CA-C-O 121.811 0.815 . . . . 0.0 112.778 -173.066 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.436 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 43.6 t -96.02 54.35 1.46 Allowed 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 115.287 -0.87 . . . . 0.0 111.245 -171.662 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 49.68 -84.61 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 125.777 1.631 . . . . 0.0 113.649 174.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 40.3 m-85 -74.73 -65.4 0.87 Allowed 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.605 1.162 . . . . 0.0 109.937 -169.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 14.0 p -75.07 -17.08 60.53 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 122.535 0.334 . . . . 0.0 111.215 -177.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 52.1 mttp 65.34 23.56 12.07 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 125.299 1.44 . . . . 0.0 113.372 176.329 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 36.2 m -69.09 128.31 36.2 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 122.563 0.345 . . . . 0.0 110.173 174.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 18.0 m -62.27 110.68 1.71 Allowed 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 176.303 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 42.0 mt -70.98 135.14 28.68 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 124.131 0.972 . . . . 0.0 110.977 -172.604 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 60.1 t -78.19 -51.76 17.08 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 C-N-CA 122.97 0.508 . . . . 0.0 109.701 177.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 50.3 m -149.91 151.51 33.53 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 -179.127 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.552 HG11 HG21 ' A' ' 35' ' ' ILE . 47.6 t -121.23 110.21 27.31 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.11 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 177.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.421 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 1.6 mp0 -92.91 154.59 18.11 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 122.909 0.484 . . . . 0.0 110.785 179.517 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -67.63 96.6 0.55 Allowed 'General case' 0 C--O 1.241 0.631 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 168.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 52.9 t90 . . . . . 0 C--O 1.238 0.454 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 176.581 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.665 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 79.4 mt . . . . . 0 CA--C 1.54 0.574 0 N-CA-C 111.497 0.184 . . . . 0.0 111.497 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 46.0 t -59.82 119.15 38.4 Favored Pre-proline 0 CA--C 1.545 0.781 0 CA-C-O 118.208 -0.901 . . . . 0.0 108.773 172.122 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -59.81 -28.17 86.61 Favored 'Trans proline' 0 C--N 1.374 1.92 0 C-N-CA 122.586 2.191 . . . . 0.0 112.39 -175.618 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 69.6 mt -72.05 -32.61 44.36 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.099 0 C-N-CA 124.758 1.223 . . . . 0.0 112.201 -179.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 79.0 m -118.37 -50.61 2.44 Favored 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -167.091 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 80.39 -42.42 0.22 Allowed 'General case' 0 N--CA 1.498 1.946 0 C-N-CA 126.594 1.958 . . . . 0.0 112.445 -179.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.95 -33.32 71.76 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.444 0.698 . . . . 0.0 112.606 -176.343 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 11.6 m170 -125.14 155.33 71.2 Favored Pre-proline 0 N--CA 1.485 1.289 0 C-N-CA 124.099 0.96 . . . . 0.0 109.196 -179.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.665 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 95.0 Cg_endo -75.64 -163.51 0.2 Allowed 'Trans proline' 0 C--N 1.38 2.224 0 C-N-CA 122.914 2.41 . . . . 0.0 113.401 -176.332 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 86.8 mt -89.11 142.72 12.48 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 C-N-CA 123.833 0.853 . . . . 0.0 108.869 171.275 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.436 ' HB3' ' H ' ' A' ' 32' ' ' LYS . 39.7 t -129.2 -16.73 3.95 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.479 0.712 . . . . 0.0 110.785 178.687 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -145.58 133.02 20.72 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -168.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.6 p -102.5 143.07 15.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 124.892 1.277 . . . . 0.0 109.542 169.409 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 18.5 m-85 -99.13 85.62 3.27 Favored 'General case' 0 C--O 1.242 0.674 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 176.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.499 ' NE2' ' HG3' ' A' ' 56' ' ' GLU . 10.1 tt0 -82.77 143.44 46.73 Favored Pre-proline 0 CA--C 1.553 1.088 0 CA-C-N 114.157 -1.383 . . . . 0.0 108.944 -174.096 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -92.41 13.64 50.37 Favored 'Cis proline' 0 C--N 1.386 2.524 0 N-CA-C 115.925 1.471 . . . . 0.0 115.925 1.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 50.8 t -62.03 -53.78 50.8 Favored 'General case' 0 N--CA 1.484 1.251 0 CA-C-N 118.55 0.614 . . . . 0.0 111.798 -177.546 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 129.43 -43.05 1.35 Allowed Glycine 0 C--N 1.347 1.176 0 CA-C-O 119.15 -0.806 . . . . 0.0 113.297 177.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.654 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 34.5 m80 -52.16 136.01 30.79 Favored 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 123.426 0.69 . . . . 0.0 112.572 -177.361 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 6.2 mptt -118.49 168.88 10.26 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.514 0.726 . . . . 0.0 110.997 178.225 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 96.9 p -170.2 -176.07 2.14 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.068 1.347 . . . . 0.0 107.738 171.057 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 17.8 p -72.63 146.69 46.43 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 168.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.436 ' H ' ' HB3' ' A' ' 20' ' ' SER . 35.2 ttpt -70.31 -16.87 63.05 Favored 'General case' 0 N--CA 1.483 1.213 0 CA-C-O 121.079 0.466 . . . . 0.0 110.882 -175.221 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.91 -39.94 91.23 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 123.646 0.779 . . . . 0.0 111.299 170.171 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.5 m -56.42 -52.42 64.72 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.761 0.824 . . . . 0.0 111.297 178.088 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.437 HD11 HG13 ' A' ' 52' ' ' ILE . 9.7 tp -71.36 -32.78 47.89 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 O-C-N 123.398 0.436 . . . . 0.0 111.04 -174.753 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -59.13 -47.96 83.36 Favored 'General case' 0 N--CA 1.484 1.242 0 CA-C-O 121.104 0.478 . . . . 0.0 110.237 173.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -73.3 -21.61 60.54 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 115.035 -0.984 . . . . 0.0 111.699 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 46.7 t60 -77.66 -37.43 49.87 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.557 0.743 . . . . 0.0 110.163 177.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 96.1 mt -73.77 0.73 12.19 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 124.025 0.93 . . . . 0.0 111.648 179.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 23.5 mmt -78.8 -14.94 58.98 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 124.134 0.973 . . . . 0.0 110.408 169.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -134.83 -70.42 0.5 Allowed 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 123.855 0.862 . . . . 0.0 109.854 179.185 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -102.25 -174.83 2.67 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 124.064 0.946 . . . . 0.0 111.873 -174.058 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -144.93 64.82 1.28 Allowed 'General case' 0 C--N 1.349 0.587 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 175.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.472 ' HB3' ' HA ' ' A' ' 49' ' ' LYS . 18.5 m-20 -137.65 159.93 40.6 Favored 'General case' 0 N--CA 1.483 1.202 0 CA-C-O 121.736 0.779 . . . . 0.0 111.295 -169.436 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.654 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 21.8 t -94.51 37.0 1.13 Allowed 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 124.891 1.276 . . . . 0.0 111.194 -172.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 58.65 -86.32 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 125.04 1.336 . . . . 0.0 113.65 169.603 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 -87.66 44.71 1.21 Allowed 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 124.871 1.268 . . . . 0.0 112.664 -167.044 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 23.5 p 175.8 -31.96 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 126.093 1.757 . . . . 0.0 107.885 -178.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.472 ' HA ' ' HB3' ' A' ' 44' ' ' ASP . 9.9 mtmp? 63.1 38.65 10.61 Favored 'General case' 0 C--N 1.365 1.258 0 C-N-CA 125.301 1.441 . . . . 0.0 111.999 -178.017 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 8.0 m -71.97 129.21 38.0 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 166.664 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 47.9 m -57.09 131.99 51.57 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 123.093 0.557 . . . . 0.0 110.551 178.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.437 HG13 HD11 ' A' ' 35' ' ' ILE . 38.0 mm -63.09 113.43 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 123.083 0.553 . . . . 0.0 111.051 -175.118 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 75.1 t -77.13 -56.76 7.14 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 170.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 62.6 m -153.21 136.17 15.48 Favored 'General case' 0 C--O 1.246 0.903 0 C-N-CA 123.312 0.645 . . . . 0.0 111.073 177.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 59.9 t -95.26 105.01 16.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 123.973 0.909 . . . . 0.0 108.667 170.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.499 ' HG3' ' NE2' ' A' ' 24' ' ' GLN . 23.6 mm-40 -97.26 146.75 24.82 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 172.649 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -75.29 112.17 11.31 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 172.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 57.7 t90 . . . . . 0 CA--C 1.544 0.741 0 C-N-CA 123.415 0.686 . . . . 0.0 111.218 -174.136 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.656 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 85.1 mt . . . . . 0 N--CA 1.471 0.598 0 CA-C-O 120.573 0.225 . . . . 0.0 111.197 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 41.2 t -60.32 118.66 35.65 Favored Pre-proline 0 CA--C 1.545 0.77 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.486 173.85 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -65.92 -15.16 47.8 Favored 'Trans proline' 0 N--CA 1.5 1.877 0 C-N-CA 122.549 2.166 . . . . 0.0 113.013 -174.352 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 43.8 mt -85.96 -20.06 8.15 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.205 0 C-N-CA 124.478 1.111 . . . . 0.0 111.034 -178.462 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 39.8 m -134.39 -51.62 0.81 Allowed 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -169.679 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 78.95 -40.08 0.24 Allowed 'General case' 0 N--CA 1.498 1.954 0 C-N-CA 126.194 1.798 . . . . 0.0 112.981 -178.345 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.18 -14.66 56.73 Favored 'General case' 0 CA--C 1.559 1.3 0 N-CA-C 113.121 0.786 . . . . 0.0 113.121 -177.083 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 57.7 m-70 -137.77 150.36 67.6 Favored Pre-proline 0 N--CA 1.485 1.288 0 C-N-CA 124.049 0.94 . . . . 0.0 109.458 172.123 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.656 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 87.6 Cg_endo -76.02 -165.7 0.32 Allowed 'Trans proline' 0 C--N 1.382 2.341 0 C-N-CA 123.144 2.563 . . . . 0.0 113.762 178.107 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 65.9 mt -78.29 149.28 5.83 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.93 0 C-N-CA 123.448 0.699 . . . . 0.0 110.445 175.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.6 m -136.13 -32.65 0.86 Allowed 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.628 0.771 . . . . 0.0 111.079 -179.213 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -130.21 152.9 49.14 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.547 0.739 . . . . 0.0 111.584 -170.26 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.47 HG13 HE22 ' A' ' 24' ' ' GLN . 7.2 p -128.53 138.69 53.94 Favored 'Isoleucine or valine' 0 C--O 1.244 0.771 0 C-N-CA 124.828 1.251 . . . . 0.0 108.29 176.066 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 19.0 m-85 -107.27 105.62 15.68 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.094 0.558 . . . . 0.0 110.782 -169.305 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.47 HE22 HG13 ' A' ' 22' ' ' VAL . 2.9 mp0 -82.6 149.37 60.57 Favored Pre-proline 0 N--CA 1.474 0.735 0 C-N-CA 123.976 0.91 . . . . 0.0 110.469 174.804 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -97.15 81.64 0.13 OUTLIER 'Cis proline' 0 C--N 1.369 1.619 0 CA-C-N 118.853 0.626 . . . . 0.0 110.871 -3.304 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 36.6 t -143.11 -64.52 0.4 Allowed 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.861 -0.609 . . . . 0.0 112.127 -175.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 114.96 -12.03 20.28 Favored Glycine 0 C--N 1.345 1.032 0 CA-C-O 118.884 -0.953 . . . . 0.0 113.79 -176.576 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.424 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 6.1 m170 -58.31 139.42 55.25 Favored 'General case' 0 N--CA 1.491 1.606 0 CA-C-N 118.17 0.985 . . . . 0.0 110.207 171.541 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 57.4 mttp -130.41 156.28 45.0 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.318 0.647 . . . . 0.0 110.729 -174.136 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 92.9 p -169.0 -179.39 3.62 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.27 1.028 . . . . 0.0 109.11 174.028 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 13.6 p -69.04 148.91 49.37 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 173.331 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -71.03 -18.16 62.59 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-N 117.859 0.3 . . . . 0.0 111.667 -174.53 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.17 -34.38 74.95 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 122.369 0.268 . . . . 0.0 111.47 171.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.7 m -60.86 -51.72 68.11 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.496 0.718 . . . . 0.0 111.243 177.223 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.426 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 10.0 tp -71.33 -31.81 44.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 O-C-N 123.236 0.335 . . . . 0.0 110.849 -176.67 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 4.7 t30 -60.93 -46.49 90.46 Favored 'General case' 0 N--CA 1.48 1.05 0 CA-C-O 121.288 0.566 . . . . 0.0 109.967 174.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 63.7 tt0 -72.09 -27.12 62.45 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.083 178.537 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 47.3 t60 -77.17 -39.24 49.7 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 122.802 0.441 . . . . 0.0 110.674 -177.777 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 69.6 mt -66.33 -25.44 66.82 Favored 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 112.828 0.677 . . . . 0.0 112.828 -173.276 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 26.6 ptm -75.19 -14.15 60.52 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 122.541 0.336 . . . . 0.0 111.482 175.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 46.1 m-80 -105.87 -67.22 0.94 Allowed 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.203 0.601 . . . . 0.0 110.401 175.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 41.5 m-80 -132.17 -168.37 2.03 Favored 'General case' 0 N--CA 1.49 1.537 0 C-N-CA 124.871 1.268 . . . . 0.0 110.75 -176.054 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 82.4 tttt -135.62 9.41 3.38 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 123.389 0.675 . . . . 0.0 110.776 176.55 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.413 ' HB2' ' HA ' ' A' ' 49' ' ' LYS . 3.7 p30 -74.64 167.61 21.44 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-O 121.336 0.588 . . . . 0.0 111.372 -179.444 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.424 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 53.5 t -90.24 52.75 2.31 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.561 0.744 . . . . 0.0 110.877 -177.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 35.6 m-85 54.97 -80.25 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 126.084 1.754 . . . . 0.0 113.262 172.644 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 48.8 m-85 -83.58 -62.69 1.51 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.334 1.054 . . . . 0.0 110.732 -172.214 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 9.4 p -80.34 -7.95 59.29 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 122.829 0.451 . . . . 0.0 111.959 -173.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.413 ' HA ' ' HB2' ' A' ' 44' ' ' ASP . 74.4 mmtt 67.99 11.52 8.4 Favored 'General case' 0 N--CA 1.484 1.27 0 N-CA-C 114.583 1.327 . . . . 0.0 114.583 172.686 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 39.3 m -64.12 136.35 57.18 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 122.886 0.474 . . . . 0.0 111.025 176.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 90.0 m -63.06 119.91 10.42 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 122.861 0.464 . . . . 0.0 110.305 176.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.416 HD11 ' HA ' ' A' ' 45' ' ' CYS . 53.3 mt -79.13 104.29 6.96 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.797 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 -178.531 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 88.0 t -75.05 -31.38 24.85 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.818 0 C-N-CA 123.722 0.809 . . . . 0.0 110.735 177.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.3 t -151.7 134.18 15.39 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-O 120.678 0.275 . . . . 0.0 111.036 179.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 59.3 t -105.11 103.42 15.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 171.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -109.28 146.04 34.94 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.094 0.558 . . . . 0.0 110.556 -175.317 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -72.09 106.69 4.43 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.239 0.616 . . . . 0.0 110.347 -177.61 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 60.3 t90 . . . . . 0 C--O 1.239 0.548 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 176.827 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.606 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 63.1 mt . . . . . 0 CA--C 1.544 0.712 0 N-CA-C 110.755 -0.091 . . . . 0.0 110.755 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.576 ' SG ' ' HB2' ' A' ' 30' ' ' SER . 43.0 t -47.38 112.0 1.87 Allowed Pre-proline 0 N--CA 1.476 0.857 0 C-N-CA 125.291 1.436 . . . . 0.0 110.617 -177.009 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -60.25 -16.66 41.98 Favored 'Trans proline' 0 N--CA 1.506 2.264 0 C-N-CA 123.041 2.494 . . . . 0.0 114.085 -169.137 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 68.4 mt -81.26 -43.13 20.27 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.108 0 C-N-CA 124.052 0.941 . . . . 0.0 110.787 177.16 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 93.1 m -97.69 -41.87 7.9 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 123.864 0.866 . . . . 0.0 112.498 -168.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 75.48 -46.45 0.57 Allowed 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 126.756 2.022 . . . . 0.0 112.333 -176.113 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.05 -37.38 87.38 Favored 'General case' 0 N--CA 1.484 1.256 0 N-CA-C 113.75 1.018 . . . . 0.0 113.75 -173.376 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 44.5 m170 -121.44 152.82 58.52 Favored Pre-proline 0 N--CA 1.484 1.26 0 C-N-CA 123.479 0.711 . . . . 0.0 109.521 -177.734 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.606 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 49.4 Cg_endo -82.4 -170.28 0.91 Allowed 'Trans proline' 0 C--N 1.379 2.151 0 C-N-CA 123.138 2.559 . . . . 0.0 114.243 -175.273 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.413 HG21 ' HB3' ' A' ' 29' ' ' LYS . 88.8 mt -81.38 140.24 16.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 123.674 0.79 . . . . 0.0 109.965 178.693 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.0 m -140.64 3.85 1.9 Allowed 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.224 0.61 . . . . 0.0 111.276 -177.104 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -152.92 157.27 40.39 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.116 0.566 . . . . 0.0 112.199 -171.131 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.9 p -135.06 140.27 45.57 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 C-N-CA 124.301 1.041 . . . . 0.0 109.185 174.249 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -99.94 99.45 10.22 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.79 0.836 . . . . 0.0 110.704 -173.459 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -72.59 146.94 89.15 Favored Pre-proline 0 N--CA 1.481 1.109 0 C-N-CA 123.845 0.858 . . . . 0.0 111.559 173.303 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 15.8 Cg_endo -95.24 28.41 17.22 Favored 'Cis proline' 0 C--N 1.377 2.027 0 C-N-CA 125.561 -0.6 . . . . 0.0 112.022 -3.621 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 36.9 t -81.36 -74.81 0.31 Allowed 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.447 0.699 . . . . 0.0 111.611 -176.041 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 136.2 -21.93 3.44 Favored Glycine 0 C--N 1.351 1.381 0 CA-C-O 119.362 -0.688 . . . . 0.0 113.927 -177.31 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.411 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 13.4 m170 -58.93 142.83 49.79 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 123.077 0.551 . . . . 0.0 111.174 178.632 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.413 ' HB3' HG21 ' A' ' 19' ' ' ILE . 53.7 mttm -129.35 145.64 51.35 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.62 0.768 . . . . 0.0 110.817 -169.526 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.576 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 96.0 p -165.65 -177.3 4.29 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.51 1.124 . . . . 0.0 108.389 173.572 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 14.1 p -66.25 142.83 57.55 Favored 'General case' 0 N--CA 1.478 0.935 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 172.17 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -62.69 -29.88 70.98 Favored 'General case' 0 N--CA 1.487 1.381 0 CA-C-N 117.888 0.313 . . . . 0.0 111.57 -177.288 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -53.85 -30.52 45.82 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.419 1.088 . . . . 0.0 112.633 176.272 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.3 m -59.28 -56.87 16.56 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.702 0.801 . . . . 0.0 111.11 175.758 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.562 HG21 HG11 ' A' ' 55' ' ' VAL . 8.3 tp -76.53 -21.71 15.09 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.68 0 O-C-N 123.351 0.407 . . . . 0.0 110.918 -174.725 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -66.03 -41.78 90.46 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 173.305 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -69.97 -40.78 75.17 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.397 0.679 . . . . 0.0 110.623 173.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.462 ' HB3' HD12 ' A' ' 35' ' ' ILE . 78.5 t60 -70.79 -34.32 71.66 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.97 -172.691 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 54.3 mt -71.06 -10.94 60.61 Favored 'General case' 0 N--CA 1.494 1.749 0 CA-C-N 118.364 0.529 . . . . 0.0 112.277 179.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 52.8 mtt -77.18 -17.4 58.58 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.381 0.673 . . . . 0.0 110.227 170.568 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 30.1 t30 -112.28 -75.12 0.61 Allowed 'General case' 0 CA--C 1.558 1.284 0 C-N-CA 124.929 1.292 . . . . 0.0 110.388 179.338 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -127.27 173.65 9.58 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 124.246 1.018 . . . . 0.0 110.961 -176.785 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -112.04 18.59 18.61 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 122.905 0.482 . . . . 0.0 111.556 -176.65 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -96.16 165.71 12.1 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-O 121.4 0.619 . . . . 0.0 112.595 -169.454 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.411 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 53.2 t -94.62 46.05 1.13 Allowed 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.791 0.836 . . . . 0.0 111.69 -174.843 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 77.5 m-85 54.19 -82.9 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 125.908 1.683 . . . . 0.0 113.54 172.524 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -71.49 -63.12 1.18 Allowed 'General case' 0 C--N 1.348 0.51 0 C-N-CA 124.32 1.048 . . . . 0.0 110.436 -171.726 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 14.6 p -79.74 -14.54 58.65 Favored 'General case' 0 N--CA 1.484 1.233 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.282 -176.254 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 88.8 mttt 64.31 14.98 9.14 Favored 'General case' 0 N--CA 1.494 1.74 0 C-N-CA 124.996 1.318 . . . . 0.0 113.518 175.681 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 16.8 m -67.77 121.91 16.97 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 174.668 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 35.2 m -62.72 117.37 6.21 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-O 121.198 0.523 . . . . 0.0 110.187 -179.102 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 57.9 mt -72.46 129.88 35.63 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 C-N-CA 124.669 1.188 . . . . 0.0 111.132 -173.282 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 76.3 t -79.62 -55.39 9.33 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 172.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.9 m -137.54 144.91 42.34 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.396 0.678 . . . . 0.0 110.284 -173.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.562 HG11 HG21 ' A' ' 35' ' ' ILE . 56.1 t -117.05 119.07 60.85 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 N-CA-C 108.493 -0.928 . . . . 0.0 108.493 171.389 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -99.92 168.32 9.95 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 122.999 0.52 . . . . 0.0 110.525 174.362 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -93.69 101.03 13.15 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 174.223 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 29.8 t90 . . . . . 0 CA--C 1.545 0.768 0 CA-C-O 120.87 0.367 . . . . 0.0 110.955 -174.092 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 81.4 mt . . . . . 0 C--O 1.239 0.548 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.452 ' SG ' ' HB2' ' A' ' 30' ' ' SER . 51.9 t -56.52 112.57 4.63 Favored Pre-proline 0 N--CA 1.484 1.251 0 CA-C-O 118.74 -0.647 . . . . 0.0 110.079 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -61.08 -17.18 50.53 Favored 'Trans proline' 0 C--N 1.377 2.078 0 C-N-CA 123.307 2.671 . . . . 0.0 113.375 -172.257 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 68.9 mt -84.55 -48.45 16.71 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.064 0 C-N-CA 124.031 0.932 . . . . 0.0 110.906 176.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 90.1 m -86.41 -53.24 5.12 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.152 0.581 . . . . 0.0 111.801 -171.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 78.39 -40.32 0.28 Allowed 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 126.515 1.926 . . . . 0.0 112.329 -175.303 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -78.0 -10.71 59.73 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 113.093 0.775 . . . . 0.0 113.093 -176.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -139.96 154.31 70.4 Favored Pre-proline 0 N--CA 1.483 1.206 0 C-N-CA 123.851 0.86 . . . . 0.0 109.383 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_endo -77.15 -173.69 1.89 Allowed 'Trans proline' 0 C--N 1.38 2.192 0 C-N-CA 123.045 2.497 . . . . 0.0 114.232 -174.334 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.512 HG21 ' HB3' ' A' ' 29' ' ' LYS . 67.5 mt -89.27 143.33 11.39 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.807 0 CA-C-N 114.767 -1.106 . . . . 0.0 109.659 175.586 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 78.4 p -150.13 19.73 0.87 Allowed 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.134 0.573 . . . . 0.0 111.195 179.683 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -158.38 138.42 12.27 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.477 0.711 . . . . 0.0 110.704 -178.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 10.5 p -116.69 139.93 41.36 Favored 'Isoleucine or valine' 0 C--O 1.245 0.824 0 C-N-CA 124.096 0.958 . . . . 0.0 109.213 171.069 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 15.0 m-85 -97.46 86.7 3.93 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 176.733 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.523 ' HG3' ' HA ' ' A' ' 25' ' ' PRO . 8.5 tt0 -91.21 140.98 25.87 Favored Pre-proline 0 CA--C 1.553 1.084 0 N-CA-C 108.358 -0.978 . . . . 0.0 108.358 -173.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.523 ' HA ' ' HG3' ' A' ' 24' ' ' GLN . 12.0 Cg_endo -94.09 22.82 28.16 Favored 'Cis proline' 0 C--N 1.387 2.583 0 N-CA-C 116.246 1.595 . . . . 0.0 116.246 7.609 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 35.3 t -68.52 -63.91 0.97 Allowed 'General case' 0 N--CA 1.481 1.08 0 CA-C-N 118.315 0.507 . . . . 0.0 111.572 178.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 124.82 -25.5 5.84 Favored Glycine 0 C--N 1.35 1.312 0 CA-C-O 119.323 -0.71 . . . . 0.0 113.17 -177.222 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.415 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 10.0 m170 -56.15 140.01 45.59 Favored 'General case' 0 N--CA 1.49 1.574 0 CA-C-N 117.25 0.525 . . . . 0.0 110.498 173.87 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.512 ' HB3' HG21 ' A' ' 19' ' ' ILE . 61.2 mttp -133.99 151.42 51.45 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.905 0.882 . . . . 0.0 110.634 -173.429 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.452 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 89.1 p -164.51 -173.86 3.22 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.82 1.248 . . . . 0.0 107.842 173.606 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.42 ' SG ' ' HB3' ' A' ' 33' ' ' ALA . 20.0 p -79.12 149.99 31.89 Favored 'General case' 0 C--O 1.244 0.766 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 173.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 63.2 pttt -65.6 -18.1 65.07 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.161 0.584 . . . . 0.0 112.169 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.42 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . . . -62.13 -40.75 96.98 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 123.318 0.647 . . . . 0.0 111.332 172.515 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.8 m -59.52 -52.8 64.01 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.618 0.767 . . . . 0.0 111.174 179.273 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.567 HG21 HG11 ' A' ' 55' ' ' VAL . 9.3 tp -73.18 -32.89 40.15 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.708 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.99 -174.41 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -61.47 -44.95 96.19 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-O 121.014 0.435 . . . . 0.0 109.986 177.567 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -60.15 -40.29 89.36 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 114.784 -1.098 . . . . 0.0 110.974 173.693 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 73.0 t60 -73.85 -33.15 63.99 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 114.759 -1.109 . . . . 0.0 111.698 -174.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 78.8 mt -71.79 -9.13 57.86 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 123.521 0.729 . . . . 0.0 112.102 -176.522 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 17.5 mmt -74.72 -24.6 58.76 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 123.18 0.592 . . . . 0.0 109.747 172.274 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 39.2 t30 -111.34 -73.13 0.69 Allowed 'General case' 0 CA--C 1.555 1.141 0 C-N-CA 124.532 1.133 . . . . 0.0 110.344 -178.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -120.71 -175.17 2.97 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 123.976 0.91 . . . . 0.0 111.15 -175.434 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt -136.63 20.25 3.1 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 123.831 0.852 . . . . 0.0 109.6 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -85.85 164.13 17.7 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 121.291 0.567 . . . . 0.0 110.868 -177.789 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.415 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 53.5 t -91.39 38.65 0.98 Allowed 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.067 0.947 . . . . 0.0 111.97 -173.165 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 57.43 -84.66 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 125.756 1.622 . . . . 0.0 112.627 171.416 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 -67.64 -50.43 58.02 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.593 1.157 . . . . 0.0 110.644 -169.222 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 14.7 p -97.63 -7.85 30.17 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.387 -177.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt 59.94 13.19 3.51 Favored 'General case' 0 CA--C 1.57 1.744 0 C-N-CA 125.506 1.522 . . . . 0.0 114.299 177.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 55.7 m -64.32 134.17 54.13 Favored 'General case' 0 N--CA 1.479 0.979 0 O-C-N 121.249 -0.907 . . . . 0.0 110.44 176.703 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 25.6 m -63.11 112.54 2.68 Favored 'General case' 0 C--O 1.245 0.868 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 177.75 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.503 HG21 HG22 ' A' ' 55' ' ' VAL . 30.5 mt -69.49 124.02 24.44 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 O-C-N 123.728 0.642 . . . . 0.0 109.825 -174.737 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 89.7 t -71.01 -51.31 36.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 O-C-N 123.705 0.628 . . . . 0.0 109.799 177.15 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 36.2 p -143.34 133.18 23.98 Favored 'General case' 0 C--O 1.249 1.026 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.703 178.595 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.567 HG11 HG21 ' A' ' 35' ' ' ILE . 23.3 t -102.04 106.97 20.69 Favored 'Isoleucine or valine' 0 C--N 1.348 0.528 0 N-CA-C 107.933 -1.136 . . . . 0.0 107.933 174.355 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -115.7 157.4 24.32 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.63 0.772 . . . . 0.0 110.215 -174.059 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -77.96 128.1 33.39 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 74.7 t90 . . . . . 0 C--O 1.236 0.361 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 175.526 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.621 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 90.2 mt . . . . . 0 N--CA 1.474 0.762 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 50.5 t -57.95 115.05 9.85 Favored Pre-proline 0 CA--C 1.548 0.901 0 O-C-N 123.874 0.734 . . . . 0.0 109.794 178.455 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_endo -57.45 -18.11 30.22 Favored 'Trans proline' 0 N--CA 1.508 2.335 0 C-N-CA 123.505 2.803 . . . . 0.0 114.034 -172.704 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 56.7 mt -90.29 -42.62 14.22 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.068 0 C-N-CA 123.954 0.902 . . . . 0.0 111.629 178.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 77.7 m -95.24 -53.37 3.81 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 123.114 0.566 . . . . 0.0 110.852 -171.645 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 20.4 t80 80.02 -41.57 0.22 Allowed 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 126.458 1.903 . . . . 0.0 112.617 175.192 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -70.03 -15.1 62.96 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.674 0.79 . . . . 0.0 112.128 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 33.7 m170 -132.1 153.38 81.32 Favored Pre-proline 0 CA--C 1.551 1.017 0 C-N-CA 124.402 1.081 . . . . 0.0 108.588 178.177 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.621 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 60.9 Cg_endo -78.82 -166.23 0.39 Allowed 'Trans proline' 0 C--N 1.379 2.141 0 C-N-CA 123.124 2.549 . . . . 0.0 113.67 -175.238 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.415 HD13 ' HB2' ' A' ' 29' ' ' LYS . 91.3 mt -96.9 146.07 7.99 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.696 0 C-N-CA 124.733 1.213 . . . . 0.0 109.313 174.185 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 28.1 t -141.96 -14.7 0.81 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 123.132 0.573 . . . . 0.0 111.805 176.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -130.95 134.21 46.52 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.135 0.574 . . . . 0.0 110.836 -174.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.485 ' HB ' ' HB2' ' A' ' 58' ' ' TRP . 7.3 p -115.85 140.34 38.14 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 124.041 0.937 . . . . 0.0 110.288 176.227 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -84.71 89.6 7.54 Favored 'General case' 0 C--O 1.242 0.66 0 C-N-CA 124.454 1.101 . . . . 0.0 108.471 175.217 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.4 ' HB3' ' HB3' ' A' ' 54' ' ' SER . 35.7 tt0 -82.18 140.77 45.95 Favored Pre-proline 0 CA--C 1.552 1.034 0 C-N-CA 124.325 1.05 . . . . 0.0 109.988 -177.058 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 14.9 Cg_endo -97.95 31.15 12.26 Favored 'Cis proline' 0 C--N 1.384 2.4 0 CA-C-N 120.226 1.116 . . . . 0.0 114.195 1.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 43.5 t -75.02 -40.91 60.26 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -177.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 85.52 23.64 46.31 Favored Glycine 0 C--N 1.345 1.045 0 C-N-CA 121.619 -0.324 . . . . 0.0 113.655 -176.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.502 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 24.8 m170 -104.59 147.84 27.18 Favored 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 166.812 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.432 ' HG3' HG23 ' A' ' 22' ' ' VAL . 6.3 mptt -132.41 169.47 16.48 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-O 121.602 0.715 . . . . 0.0 112.126 -171.039 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 84.3 p -169.19 -166.43 0.62 Allowed 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.664 1.586 . . . . 0.0 107.594 170.225 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 19.0 p -89.37 154.42 20.08 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 168.248 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.9 -33.99 72.6 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.415 0.686 . . . . 0.0 110.859 -176.551 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -54.88 -40.54 69.85 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.9 0.88 . . . . 0.0 112.52 177.519 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 9.0 m -62.01 -54.56 39.91 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.553 0.741 . . . . 0.0 111.21 178.577 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.411 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 9.5 tp -69.53 -32.55 53.28 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 O-C-N 123.055 0.222 . . . . 0.0 110.739 -175.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 4.6 t30 -58.77 -48.03 82.66 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.643 0.777 . . . . 0.0 110.626 176.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -62.46 -42.18 99.3 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 114.866 -1.061 . . . . 0.0 111.014 176.117 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 52.2 t60 -63.49 -38.52 91.45 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.695 0.798 . . . . 0.0 111.049 -178.749 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.411 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 96.1 mt -69.81 -11.29 60.74 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.809 0.844 . . . . 0.0 112.051 -177.116 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 45.6 mtm -76.48 -15.22 59.95 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 122.821 0.448 . . . . 0.0 111.059 172.545 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 19.3 m-80 -121.09 -64.91 1.19 Allowed 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 124.463 1.105 . . . . 0.0 110.376 -173.726 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 31.1 m-80 -126.81 -174.42 3.13 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 124.842 1.257 . . . . 0.0 109.468 -177.376 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp -137.18 68.89 1.41 Allowed 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 178.063 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.1 m-20 -139.21 165.79 26.24 Favored 'General case' 0 N--CA 1.494 1.726 0 CA-C-O 121.908 0.861 . . . . 0.0 112.076 -168.616 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.502 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 43.7 t -89.67 24.32 2.37 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 125.154 1.382 . . . . 0.0 112.239 -172.03 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 58.93 -86.0 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 125.158 1.383 . . . . 0.0 112.495 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -67.64 -40.39 84.59 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 125.407 1.483 . . . . 0.0 111.382 -162.239 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 7.5 p -108.74 -2.48 18.56 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.181 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 64.5 tttp 66.97 -2.27 1.19 Allowed 'General case' 0 CA--C 1.565 1.526 0 N-CA-C 114.657 1.355 . . . . 0.0 114.657 174.054 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 24.2 m -55.77 124.29 17.02 Favored 'General case' 0 N--CA 1.489 1.523 0 CA-C-N 119.16 0.891 . . . . 0.0 111.112 178.671 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 89.2 m -57.28 134.54 56.05 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.289 0.635 . . . . 0.0 111.674 -178.549 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 48.8 mm -62.38 118.67 4.95 Favored 'Isoleucine or valine' 0 C--N 1.354 0.768 0 C-N-CA 123.511 0.724 . . . . 0.0 110.732 -176.241 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 59.9 t -90.92 -40.33 12.54 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 172.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.4 ' HB3' ' HB3' ' A' ' 24' ' ' GLN . 24.9 t -154.35 146.79 23.98 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.49 0.716 . . . . 0.0 110.148 179.061 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 66.0 t -112.66 103.19 15.05 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 168.59 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -97.25 156.36 16.46 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.528 0.731 . . . . 0.0 109.114 178.046 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -75.65 107.7 7.98 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 170.007 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' TRP . . . . . 0.485 ' HB2' ' HB ' ' A' ' 22' ' ' VAL . 39.3 t90 . . . . . 0 C--O 1.241 0.651 0 O-C-N 123.237 0.336 . . . . 0.0 110.21 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.612 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 92.8 mt . . . . . 0 N--CA 1.47 0.538 0 CA-C-O 120.513 0.197 . . . . 0.0 111.256 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 42.5 t -61.61 119.26 45.66 Favored Pre-proline 0 N--CA 1.475 0.794 0 CA-C-O 118.744 -0.646 . . . . 0.0 110.37 178.223 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -67.0 -11.49 32.46 Favored 'Trans proline' 0 C--N 1.376 2.023 0 C-N-CA 122.746 2.297 . . . . 0.0 113.208 -177.748 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 68.4 mt -97.73 -28.41 3.69 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.153 0 C-N-CA 124.52 1.128 . . . . 0.0 111.886 -176.127 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 71.1 m -115.81 -38.87 3.59 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 122.841 0.456 . . . . 0.0 110.807 -173.188 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 11.0 t80 79.98 -54.77 0.38 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 126.703 2.001 . . . . 0.0 111.802 175.166 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.5 -38.95 85.99 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 124.084 0.953 . . . . 0.0 112.797 -175.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 65.2 m170 -103.88 153.93 38.42 Favored Pre-proline 0 N--CA 1.486 1.371 0 C-N-CA 123.712 0.805 . . . . 0.0 110.445 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.612 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 97.9 Cg_endo -75.27 -167.83 0.47 Allowed 'Trans proline' 0 C--N 1.38 2.221 0 C-N-CA 123.077 2.518 . . . . 0.0 113.597 -177.361 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.538 HG21 ' HB3' ' A' ' 29' ' ' LYS . 38.8 mt -96.94 147.29 6.41 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 C-N-CA 124.005 0.922 . . . . 0.0 109.938 174.676 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 34.3 p -154.87 25.12 0.44 Allowed 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.995 0.918 . . . . 0.0 110.542 179.141 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -152.56 141.81 21.47 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 124.167 0.987 . . . . 0.0 110.031 178.051 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 6.4 p -137.18 118.99 18.78 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 C-N-CA 124.236 1.014 . . . . 0.0 108.442 176.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -85.02 92.95 8.47 Favored 'General case' 0 C--O 1.244 0.812 0 N-CA-C 108.423 -0.955 . . . . 0.0 108.423 -174.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -83.42 152.62 64.49 Favored Pre-proline 0 CA--C 1.545 0.753 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.498 -178.167 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -89.78 18.12 39.52 Favored 'Cis proline' 0 C--N 1.38 2.223 0 N-CA-C 114.297 0.845 . . . . 0.0 114.297 0.413 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 36.6 t -65.4 -64.59 0.83 Allowed 'General case' 0 C--N 1.356 0.871 0 C-N-CA 123.064 0.545 . . . . 0.0 111.84 -176.549 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 125.67 -19.73 6.58 Favored Glycine 0 C--N 1.345 1.062 0 CA-C-O 118.951 -0.916 . . . . 0.0 113.465 -176.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.455 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 9.4 m170 -61.01 144.41 53.45 Favored 'General case' 0 N--CA 1.487 1.409 0 CA-C-N 117.733 0.766 . . . . 0.0 110.494 176.728 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.538 ' HB3' HG21 ' A' ' 19' ' ' ILE . 58.3 mttp -136.48 157.45 46.75 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 123.876 0.87 . . . . 0.0 110.798 -170.534 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 94.6 p -169.04 179.55 4.0 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.86 1.264 . . . . 0.0 108.556 171.739 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 14.4 p -68.12 142.17 55.86 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 171.343 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.99 -21.65 66.29 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -175.104 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -58.63 -38.47 78.14 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.881 0.873 . . . . 0.0 111.329 173.247 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.8 m -58.59 -55.63 32.53 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 124.07 0.948 . . . . 0.0 111.592 177.359 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.53 HG12 HG21 ' A' ' 55' ' ' VAL . 9.2 tp -73.6 -33.86 40.19 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 O-C-N 123.422 0.451 . . . . 0.0 111.19 -173.269 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -62.96 -41.03 99.41 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-O 120.944 0.402 . . . . 0.0 110.429 175.79 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -74.88 -28.67 60.74 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 123.685 0.794 . . . . 0.0 110.915 176.707 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 83.2 t60 -69.79 -45.81 67.15 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.841 0.856 . . . . 0.0 110.417 -178.259 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 97.4 mt -60.82 -19.08 59.06 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 124.083 0.953 . . . . 0.0 112.656 -176.356 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 84.4 mmm -61.56 -32.59 72.67 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.37 1.068 . . . . 0.0 112.002 173.651 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 77.3 m-20 -116.4 -58.24 2.11 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.34 0.656 . . . . 0.0 111.134 -176.787 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -122.71 160.66 25.41 Favored 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 124.144 0.977 . . . . 0.0 110.947 -176.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 47.6 mtpt -126.46 63.66 1.27 Allowed 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 174.844 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -128.59 158.12 39.37 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 115.136 -0.938 . . . . 0.0 109.944 -174.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.455 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 42.3 t -87.7 37.37 0.79 Allowed 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 123.675 0.79 . . . . 0.0 111.875 -176.396 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 57.6 -85.3 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 125.697 1.599 . . . . 0.0 112.775 173.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 -74.82 -39.07 61.86 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.639 1.176 . . . . 0.0 111.758 -165.217 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 14.2 p -107.05 -2.53 20.97 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 122.952 0.501 . . . . 0.0 110.994 -179.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 83.8 tttt 66.39 -4.18 0.74 Allowed 'General case' 0 CA--C 1.566 1.582 0 C-N-CA 125.492 1.517 . . . . 0.0 114.917 176.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 22.9 m -51.11 121.16 5.7 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 119.27 0.941 . . . . 0.0 111.128 -177.299 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 20.6 m -51.6 127.84 21.49 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.393 0.677 . . . . 0.0 110.772 -177.077 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.454 HG13 HD11 ' A' ' 35' ' ' ILE . 42.4 mm -60.71 103.28 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.353 0.724 0 O-C-N 123.756 0.66 . . . . 0.0 110.64 -175.542 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 47.4 t -75.76 -55.4 11.5 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 CA-C-N 115.047 -0.979 . . . . 0.0 108.44 174.207 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.8 t -153.57 153.06 31.66 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 123.128 0.571 . . . . 0.0 110.582 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.53 HG21 HG12 ' A' ' 35' ' ' ILE . 58.1 t -127.53 127.13 68.43 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 124.532 1.133 . . . . 0.0 108.462 175.428 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -108.64 143.72 37.34 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.599 0.76 . . . . 0.0 109.055 173.128 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -66.13 106.21 1.58 Allowed 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 108.428 -0.952 . . . . 0.0 108.428 174.313 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 72.1 t90 . . . . . 0 CA--C 1.541 0.613 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 177.209 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.739 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 94.6 mt . . . . . 0 C--O 1.236 0.379 0 CA-C-O 121.283 0.563 . . . . 0.0 111.777 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.42 ' SG ' ' HB ' ' A' ' 13' ' ' ILE . 51.0 t -67.15 114.34 17.97 Favored Pre-proline 0 CA--C 1.545 0.759 0 CA-C-N 114.413 -1.267 . . . . 0.0 109.223 171.583 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -64.0 -8.28 15.66 Favored 'Trans proline' 0 C--N 1.374 1.897 0 C-N-CA 122.814 2.343 . . . . 0.0 113.353 -179.324 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.42 ' HB ' ' SG ' ' A' ' 11' ' ' CYS . 3.6 mp -84.52 -44.98 17.9 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.989 0 C-N-CA 124.186 0.994 . . . . 0.0 110.172 175.258 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 78.8 m -107.39 -46.87 3.76 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.348 0.659 . . . . 0.0 112.688 -165.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 97.6 m-85 76.81 -39.17 0.33 Allowed 'General case' 0 N--CA 1.499 2.012 0 C-N-CA 126.196 1.798 . . . . 0.0 113.419 178.337 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.75 -20.58 65.25 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.371 0.668 . . . . 0.0 112.797 -177.293 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 80.3 m-70 -134.72 152.74 78.14 Favored Pre-proline 0 C--O 1.248 0.977 0 C-N-CA 123.728 0.811 . . . . 0.0 109.371 -179.14 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.739 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 83.0 Cg_endo -72.66 -166.07 0.26 Allowed 'Trans proline' 0 C--N 1.38 2.224 0 C-N-CA 122.925 2.417 . . . . 0.0 113.822 -178.291 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.604 HG21 ' HB3' ' A' ' 29' ' ' LYS . 92.4 mt -94.64 146.0 7.33 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 C-N-CA 124.469 1.108 . . . . 0.0 108.63 172.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 18.9 t -147.33 9.36 0.95 Allowed 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.172 0.589 . . . . 0.0 110.922 178.26 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.412 ' HA ' ' HA ' ' A' ' 57' ' ' ASP . . . -142.29 141.96 32.48 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.173 0.589 . . . . 0.0 110.677 -179.014 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.1 p -119.35 136.99 54.73 Favored 'Isoleucine or valine' 0 C--O 1.245 0.83 0 C-N-CA 124.08 0.952 . . . . 0.0 109.491 177.763 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.408 ' HB3' HG12 ' A' ' 52' ' ' ILE . 10.3 m-30 -98.63 87.44 3.8 Favored 'General case' 0 C--O 1.241 0.644 0 C-N-CA 123.877 0.871 . . . . 0.0 109.057 -177.134 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 17.0 mt-30 -81.9 147.6 58.73 Favored Pre-proline 0 CA--C 1.546 0.803 0 CA-C-N 115.217 -0.901 . . . . 0.0 111.383 -176.403 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.497 ' HD3' ' HB ' ' A' ' 53' ' ' VAL . 43.6 Cg_endo -97.44 24.36 22.42 Favored 'Cis proline' 0 C--N 1.374 1.871 0 C-N-CA 125.322 -0.699 . . . . 0.0 113.384 -0.267 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 37.5 t -71.53 -49.37 41.49 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 122.696 0.398 . . . . 0.0 110.759 -179.102 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 108.79 -12.66 35.12 Favored Glycine 0 C--N 1.348 1.229 0 CA-C-O 119.429 -0.651 . . . . 0.0 114.032 179.119 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.414 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 11.1 m80 -64.53 143.51 57.86 Favored 'General case' 0 N--CA 1.484 1.269 0 CA-C-N 117.391 0.596 . . . . 0.0 110.351 173.487 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.604 ' HB3' HG21 ' A' ' 19' ' ' ILE . 96.2 mttt -135.54 149.6 49.51 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.632 0.773 . . . . 0.0 110.844 -168.831 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 47.2 t -157.64 173.75 16.38 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.253 1.021 . . . . 0.0 109.069 178.785 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 12.3 p -68.0 146.87 53.13 Favored 'General case' 0 C--O 1.243 0.757 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 176.161 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt -61.78 -28.25 69.32 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.456 0.702 . . . . 0.0 111.777 -174.479 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -62.68 -42.18 99.49 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.765 0.826 . . . . 0.0 111.933 178.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.1 m -56.09 -56.21 23.65 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.315 0.646 . . . . 0.0 111.271 178.408 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.443 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 7.7 tp -73.67 -34.37 41.08 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.75 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.285 -173.767 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -56.85 -46.76 81.56 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 123.294 0.637 . . . . 0.0 110.429 177.054 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -66.41 -40.64 89.71 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.68 176.271 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 82.5 t60 -74.16 -24.28 59.37 Favored 'General case' 0 C--O 1.215 -0.754 0 CA-C-N 115.272 -0.877 . . . . 0.0 112.722 -172.414 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.443 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 73.2 mt -61.95 -22.41 65.6 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 122.985 0.514 . . . . 0.0 111.976 -179.143 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 24.6 mmt -75.34 -31.14 60.47 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 123.697 0.799 . . . . 0.0 110.643 174.241 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 23.6 m-20 -84.18 -76.33 0.3 Allowed 'General case' 0 CA--C 1.553 1.058 0 C-N-CA 123.937 0.895 . . . . 0.0 109.251 177.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -141.45 -167.23 2.37 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 125.198 1.399 . . . . 0.0 109.641 -176.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -141.98 87.72 2.06 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 173.516 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -152.17 162.42 41.15 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.062 179.564 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.414 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 79.3 m -62.18 142.33 57.7 Favored 'General case' 0 C--N 1.347 0.465 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.206 173.605 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 71.1 m-85 -82.86 26.34 0.6 Allowed 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.379 0.672 . . . . 0.0 110.271 172.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 48.4 m-85 -139.38 -77.2 0.34 Allowed 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 124.21 1.004 . . . . 0.0 108.93 -169.11 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.475 ' HG ' ' HG1' ' A' ' 50' ' ' THR . 1.8 p -95.07 -1.86 51.28 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.178 0.591 . . . . 0.0 111.394 -177.388 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 8.6 mtmp? 63.78 9.54 4.5 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 125.04 1.336 . . . . 0.0 113.928 176.598 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.475 ' HG1' ' HG ' ' A' ' 48' ' ' CYS . 87.4 m -65.6 128.84 37.57 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.236 0.614 . . . . 0.0 111.116 177.351 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 56.9 m -58.16 133.64 55.79 Favored 'General case' 0 C--N 1.352 0.695 0 O-C-N 124.456 1.098 . . . . 0.0 111.512 178.306 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.451 HG21 HG22 ' A' ' 55' ' ' VAL . 30.8 mt -86.6 119.9 35.33 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 C-N-CA 123.907 0.883 . . . . 0.0 109.716 -177.621 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.497 ' HB ' ' HD3' ' A' ' 25' ' ' PRO . 61.1 t -78.91 -35.46 17.86 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.922 0 C-N-CA 123.096 0.558 . . . . 0.0 109.96 178.85 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.7 t -145.91 131.7 19.03 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 122.941 0.496 . . . . 0.0 110.331 175.46 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.451 HG22 HG21 ' A' ' 52' ' ' ILE . 56.6 t -100.48 111.89 31.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 175.771 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -117.71 -178.52 3.5 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 123.095 0.558 . . . . 0.0 110.179 174.544 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . 0.412 ' HA ' ' HA ' ' A' ' 21' ' ' ALA . 35.9 m-20 -100.05 164.37 12.02 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.589 0.756 . . . . 0.0 109.947 178.446 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 54.7 t90 . . . . . 0 N--CA 1.465 0.303 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 179.594 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.567 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 59.6 mt . . . . . 0 C--O 1.236 0.353 0 N-CA-C 110.577 -0.157 . . . . 0.0 110.577 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 46.1 t -50.19 114.78 4.69 Favored Pre-proline 0 CA--C 1.546 0.825 0 O-C-N 124.387 1.054 . . . . 0.0 109.869 179.445 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_exo -57.55 -14.33 16.45 Favored 'Trans proline' 0 C--N 1.38 2.236 0 C-N-CA 123.352 2.701 . . . . 0.0 114.358 -172.778 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.6 mp -89.51 -42.47 14.4 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.253 0 C-N-CA 124.272 1.029 . . . . 0.0 110.047 177.507 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 79.8 m -102.12 -55.03 2.57 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.599 0.76 . . . . 0.0 112.688 -169.04 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.502 ' HA ' ' HB3' ' A' ' 10' ' ' LEU . 96.0 m-85 77.09 -32.29 0.18 Allowed 'General case' 0 N--CA 1.495 1.804 0 C-N-CA 126.318 1.847 . . . . 0.0 113.345 -178.528 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.5 -36.91 79.48 Favored 'General case' 0 N--CA 1.484 1.25 0 CA-C-N 118.564 0.62 . . . . 0.0 111.917 -179.152 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 10.9 m170 -127.07 155.14 76.42 Favored Pre-proline 0 N--CA 1.482 1.145 0 C-N-CA 124.441 1.097 . . . . 0.0 109.139 178.77 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.567 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 92.6 Cg_endo -76.91 -159.6 0.1 Allowed 'Trans proline' 0 C--N 1.376 2.023 0 C-N-CA 122.707 2.272 . . . . 0.0 113.936 179.379 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.442 HG21 ' HB3' ' A' ' 29' ' ' LYS . 83.0 mt -78.58 138.0 20.95 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.799 0 C-N-CA 124.285 1.034 . . . . 0.0 110.906 177.504 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.2 m -110.8 -27.77 8.71 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.568 0.747 . . . . 0.0 110.731 176.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.457 ' HB1' HG12 ' A' ' 55' ' ' VAL . . . -147.58 154.16 40.34 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.096 0.558 . . . . 0.0 111.778 -166.097 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 5.7 p -123.46 124.81 70.51 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.95 0 C-N-CA 124.552 1.141 . . . . 0.0 109.851 179.311 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -77.41 94.7 4.28 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.12 0.968 . . . . 0.0 108.97 178.55 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 -98.09 155.46 36.98 Favored Pre-proline 0 CA--C 1.546 0.823 0 C-N-CA 123.054 0.542 . . . . 0.0 111.14 -174.603 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -85.72 18.89 27.95 Favored 'Cis proline' 0 C--N 1.383 2.378 0 N-CA-C 115.049 1.134 . . . . 0.0 115.049 3.342 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 53.4 t -67.8 -65.07 0.74 Allowed 'General case' 0 C--N 1.354 0.765 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -177.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 124.93 -16.87 7.25 Favored Glycine 0 C--N 1.35 1.313 0 CA-C-O 119.13 -0.817 . . . . 0.0 114.211 179.5 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.569 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 21.5 m80 -63.94 149.14 47.89 Favored 'General case' 0 N--CA 1.482 1.146 0 CA-C-N 117.644 0.722 . . . . 0.0 110.206 171.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.442 ' HB3' HG21 ' A' ' 19' ' ' ILE . 83.1 mttt -137.22 161.58 35.82 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 123.703 0.801 . . . . 0.0 110.77 -168.324 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 38.3 t -172.98 178.65 2.48 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.847 1.259 . . . . 0.0 108.714 178.344 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 13.6 p -79.36 153.11 30.01 Favored 'General case' 0 C--O 1.246 0.9 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 173.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt -67.19 -23.6 65.77 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.289 0.636 . . . . 0.0 111.767 -173.353 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.51 -42.29 92.22 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.744 0.818 . . . . 0.0 111.553 177.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 8.7 m -56.78 -54.5 45.63 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.447 0.699 . . . . 0.0 110.851 176.429 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.531 HG12 HG21 ' A' ' 55' ' ' VAL . 9.8 tp -74.97 -23.36 17.39 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.982 0 O-C-N 123.688 0.617 . . . . 0.0 111.11 -174.67 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -62.56 -55.41 27.49 Favored 'General case' 0 N--CA 1.487 1.414 0 CA-C-O 121.505 0.669 . . . . 0.0 109.868 173.831 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 61.0 tt0 -70.44 -19.55 62.96 Favored 'General case' 0 CA--C 1.553 1.06 0 CA-C-N 114.519 -1.219 . . . . 0.0 111.063 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 62.7 t60 -81.51 -41.74 21.25 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.347 0.659 . . . . 0.0 111.367 178.685 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 48.9 mt -66.85 -24.49 66.15 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.122 0.569 . . . . 0.0 112.527 -173.445 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 27.3 ptm -69.99 -21.21 63.25 Favored 'General case' 0 N--CA 1.482 1.174 0 CA-C-O 120.576 0.226 . . . . 0.0 110.957 175.315 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 66.0 m-20 -106.02 -73.86 0.67 Allowed 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.882 0.873 . . . . 0.0 109.749 -179.041 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -111.68 -174.57 2.49 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 124.545 1.138 . . . . 0.0 110.491 -176.736 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 22.1 ttmm -139.82 15.64 2.49 Favored 'General case' 0 N--CA 1.486 1.33 0 CA-C-O 121.484 0.659 . . . . 0.0 110.665 179.63 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -88.86 164.17 15.31 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-O 121.326 0.584 . . . . 0.0 111.408 -174.469 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.569 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 43.5 t -91.66 32.87 1.05 Allowed 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 124.526 1.13 . . . . 0.0 112.664 -172.427 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 57.7 -83.46 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 125.231 1.413 . . . . 0.0 112.646 174.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -67.55 -24.96 65.59 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 125.505 1.522 . . . . 0.0 112.735 -167.022 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 15.2 p -131.03 -7.48 3.9 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 122.93 0.492 . . . . 0.0 111.195 -176.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 55.2 tttm 64.48 11.91 6.96 Favored 'General case' 0 CA--C 1.569 1.691 0 C-N-CA 124.784 1.234 . . . . 0.0 113.548 177.002 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 26.7 m -62.86 133.7 55.1 Favored 'General case' 0 N--CA 1.481 1.088 0 O-C-N 121.407 -0.808 . . . . 0.0 110.451 176.412 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 23.8 m -60.79 119.84 8.96 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.112 0.565 . . . . 0.0 110.323 179.385 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.483 HG21 HG22 ' A' ' 55' ' ' VAL . 46.6 mt -79.54 122.2 34.29 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 O-C-N 123.454 0.471 . . . . 0.0 109.754 -179.68 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 46.2 t -81.53 -38.53 16.3 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 C-N-CA 123.208 0.603 . . . . 0.0 109.553 175.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 34.2 p -168.11 136.97 2.41 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.706 0.803 . . . . 0.0 110.713 175.615 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.531 HG21 HG12 ' A' ' 35' ' ' ILE . 21.7 t -96.72 113.56 31.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 123.87 0.868 . . . . 0.0 109.254 178.064 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.1 mm-40 -85.24 172.86 10.82 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 110.073 -0.343 . . . . 0.0 110.073 175.313 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -87.52 135.56 33.3 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 174.212 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 73.4 t90 . . . . . 0 N--CA 1.477 0.906 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 175.698 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.611 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 93.3 mt . . . . . 0 N--CA 1.479 1.023 0 N-CA-C 110.617 -0.142 . . . . 0.0 110.617 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.463 ' HB3' ' HB2' ' A' ' 14' ' ' CYS . 42.4 t -66.74 116.42 34.77 Favored Pre-proline 0 CA--C 1.552 1.041 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 175.468 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_endo -58.23 -17.28 31.78 Favored 'Trans proline' 0 C--N 1.382 2.321 0 C-N-CA 123.417 2.745 . . . . 0.0 114.119 -174.683 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 73.3 mt -88.17 -45.88 15.81 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.885 0 C-N-CA 123.882 0.873 . . . . 0.0 110.788 176.544 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.463 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . 86.3 m -90.76 -55.58 3.51 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.126 0.57 . . . . 0.0 111.73 -167.861 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 84.3 m-85 74.84 -43.32 0.52 Allowed 'General case' 0 N--CA 1.494 1.743 0 C-N-CA 126.285 1.834 . . . . 0.0 111.872 -174.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.3 -30.6 71.26 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 124.004 0.921 . . . . 0.0 112.372 -178.752 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 21.7 m-70 -124.4 151.23 66.35 Favored Pre-proline 0 N--CA 1.479 1.016 0 C-N-CA 124.047 0.939 . . . . 0.0 109.521 176.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.611 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 13.1 Cg_exo -71.36 -164.55 0.16 Allowed 'Trans proline' 0 C--N 1.381 2.259 0 C-N-CA 123.898 3.066 . . . . 0.0 114.086 -177.075 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 83.2 mt -86.51 129.93 37.52 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.84 0 C-N-CA 123.466 0.706 . . . . 0.0 110.065 175.726 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 25.8 t -132.46 6.44 4.11 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 123.876 0.87 . . . . 0.0 110.875 178.733 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -154.95 160.93 41.48 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-O 121.343 0.592 . . . . 0.0 111.413 -178.279 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 4.7 p -145.71 139.76 21.52 Favored 'Isoleucine or valine' 0 C--O 1.244 0.781 0 C-N-CA 124.863 1.265 . . . . 0.0 108.752 177.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -96.79 88.11 4.5 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 178.125 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 16.1 mt-30 -84.95 149.41 53.24 Favored Pre-proline 0 C--O 1.242 0.704 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.359 -176.407 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -92.29 22.38 29.34 Favored 'Cis proline' 0 C--N 1.383 2.368 0 N-CA-C 114.776 1.029 . . . . 0.0 114.776 2.209 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 35.3 t -69.13 -50.12 50.85 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 122.767 0.427 . . . . 0.0 111.555 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 105.58 -6.08 41.23 Favored Glycine 0 C--N 1.343 0.96 0 CA-C-O 118.967 -0.907 . . . . 0.0 114.619 177.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.437 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 3.8 m170 -62.99 128.14 34.47 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 117.662 0.731 . . . . 0.0 110.016 173.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -101.21 156.82 17.21 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.219 1.008 . . . . 0.0 110.897 -174.049 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 79.9 p -168.72 -157.34 0.19 Allowed 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.415 1.086 . . . . 0.0 108.257 175.176 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 30.8 p -116.44 161.19 19.46 Favored 'General case' 0 C--O 1.247 0.964 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 170.179 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 57.5 mtpt -57.07 -40.17 76.39 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 123.494 0.718 . . . . 0.0 111.12 -179.295 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -53.83 -42.13 68.12 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 123.918 0.887 . . . . 0.0 113.086 179.197 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 8.7 m -60.32 -56.63 19.1 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.653 0.781 . . . . 0.0 111.274 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.422 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 8.6 tp -72.92 -35.36 48.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.519 -171.901 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -61.29 -47.45 85.91 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.207 0.603 . . . . 0.0 111.279 177.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 37.0 tt0 -62.94 -34.38 77.35 Favored 'General case' 0 CA--C 1.554 1.102 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.657 176.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 84.8 t60 -73.56 -37.51 65.52 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.274 1.03 . . . . 0.0 112.477 -178.334 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 77.8 mt -64.6 -17.56 64.11 Favored 'General case' 0 N--CA 1.492 1.644 0 C-N-CA 123.505 0.722 . . . . 0.0 112.569 -174.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 87.1 mtp -66.86 -29.16 68.99 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.297 0.639 . . . . 0.0 111.021 174.271 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 31.5 t30 -105.15 -72.89 0.69 Allowed 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 123.91 0.884 . . . . 0.0 110.269 177.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 79.3 m-20 -115.98 164.61 14.17 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.45 0.7 . . . . 0.0 110.783 -173.873 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -124.51 45.65 2.47 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.065 0.946 . . . . 0.0 108.93 176.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -109.18 168.65 9.22 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.498 177.547 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.437 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 41.6 t -93.61 32.5 1.39 Allowed 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 124.668 1.187 . . . . 0.0 111.922 -171.414 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 59.4 -84.35 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 125.616 1.566 . . . . 0.0 112.287 175.817 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 16.4 m-85 -70.6 -32.98 70.54 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.879 1.272 . . . . 0.0 112.05 -164.606 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 14.8 p -119.53 -6.2 10.24 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 122.926 0.49 . . . . 0.0 111.161 -178.109 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 55.4 mtpt 60.28 18.69 8.21 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 114.82 1.415 . . . . 0.0 114.82 178.559 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 45.6 m -62.9 137.1 58.18 Favored 'General case' 0 N--CA 1.48 1.053 0 CA-C-N 118.173 0.442 . . . . 0.0 109.936 174.081 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 29.0 m -58.15 129.64 42.93 Favored 'General case' 0 C--O 1.246 0.9 0 C-N-CA 123.24 0.616 . . . . 0.0 110.331 177.69 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 41.9 mm -66.64 102.01 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.814 0 O-C-N 123.724 0.64 . . . . 0.0 109.724 179.046 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 97.7 t -73.16 -37.69 53.17 Favored 'Isoleucine or valine' 0 C--O 1.242 0.687 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 172.071 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.8 p -158.57 133.21 8.17 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.455 174.521 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 48.5 t -90.37 116.99 32.75 Favored 'Isoleucine or valine' 0 C--N 1.353 0.73 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 163.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -122.63 135.55 54.64 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 177.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -60.92 159.16 11.81 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.665 0.786 . . . . 0.0 110.201 173.344 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 37.3 t90 . . . . . 0 CA--C 1.538 0.483 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 -177.138 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.511 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 74.4 mt . . . . . 0 N--CA 1.476 0.867 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 52.5 t -57.2 114.93 9.09 Favored Pre-proline 0 CA--C 1.55 0.952 0 O-C-N 124.308 1.005 . . . . 0.0 108.868 174.143 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -57.35 -19.84 37.13 Favored 'Trans proline' 0 N--CA 1.508 2.361 0 C-N-CA 123.373 2.716 . . . . 0.0 114.185 -175.172 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.8 mp -80.02 -26.76 12.04 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.468 0 C-N-CA 124.269 1.028 . . . . 0.0 110.774 -176.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 40.4 m -133.33 -42.06 0.87 Allowed 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 113.256 0.836 . . . . 0.0 113.256 -161.162 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 93.1 m-85 77.94 -37.64 0.24 Allowed 'General case' 0 N--CA 1.496 1.846 0 C-N-CA 126.248 1.819 . . . . 0.0 113.108 178.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -74.59 -6.95 51.44 Favored 'General case' 0 CA--C 1.555 1.156 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 -169.032 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 66.9 m-70 -141.49 137.72 16.74 Favored Pre-proline 0 N--CA 1.494 1.734 0 CA-C-N 118.658 0.663 . . . . 0.0 109.936 174.634 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.511 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 47.2 Cg_endo -88.62 80.69 0.94 Allowed 'Trans proline' 0 C--N 1.383 2.355 0 C-N-CA 123.429 2.753 . . . . 0.0 114.027 -178.725 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 64.7 mt 63.07 155.5 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.037 0 C-N-CA 124.948 1.299 . . . . 0.0 111.957 -178.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.416 ' HB3' ' H ' ' A' ' 32' ' ' LYS . 26.3 t -159.81 -7.6 0.06 Allowed 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 122.696 0.398 . . . . 0.0 111.766 173.126 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -152.03 132.52 13.83 Favored 'General case' 0 N--CA 1.481 1.083 0 CA-C-N 118.348 0.522 . . . . 0.0 111.144 -175.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.2 p -102.41 132.89 47.53 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.88 0 C-N-CA 124.231 1.013 . . . . 0.0 109.834 173.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -93.71 100.11 12.39 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.118 -178.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 -90.02 151.47 45.14 Favored Pre-proline 0 CA--C 1.545 0.759 0 C-N-CA 123.61 0.764 . . . . 0.0 110.92 178.07 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_endo -92.44 32.21 10.7 Favored 'Cis proline' 0 C--N 1.376 2.011 0 CA-C-N 118.528 0.51 . . . . 0.0 113.112 3.436 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.7 t -83.49 -72.83 0.44 Allowed 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 122.67 0.388 . . . . 0.0 111.246 -179.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 133.67 -30.4 2.99 Favored Glycine 0 C--N 1.349 1.254 0 CA-C-O 119.696 -0.502 . . . . 0.0 112.674 -176.028 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 20.1 m170 -57.29 132.3 52.62 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 123.385 0.674 . . . . 0.0 110.717 175.536 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 50.3 mttp -115.52 150.66 36.2 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.152 0.981 . . . . 0.0 110.44 -175.847 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 54.5 p -142.13 -155.94 0.64 Allowed 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 166.168 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 22.3 p -99.41 162.09 13.24 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 118.312 0.506 . . . . 0.0 109.79 173.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.416 ' H ' ' HB3' ' A' ' 20' ' ' SER . 56.0 mtpt -63.58 -34.6 78.18 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.029 0.932 . . . . 0.0 111.282 -179.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.87 -32.51 70.78 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.42 0.688 . . . . 0.0 111.584 176.761 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.4 m -63.52 -55.39 24.35 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.507 0.723 . . . . 0.0 111.07 176.574 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.663 HG12 HG21 ' A' ' 55' ' ' VAL . 8.8 tp -69.75 -37.74 74.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 O-C-N 123.579 0.549 . . . . 0.0 110.95 -173.491 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -63.47 -38.44 91.15 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-O 121.134 0.492 . . . . 0.0 110.683 178.561 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -73.18 -32.69 64.98 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 123.538 0.735 . . . . 0.0 110.675 175.423 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 59.8 t60 -72.94 -32.5 65.32 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.86 0.864 . . . . 0.0 110.713 -176.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 97.4 mt -72.39 -7.42 49.6 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.864 0.866 . . . . 0.0 111.9 -179.072 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 92.9 mmm -74.31 -14.11 60.85 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 123.657 0.783 . . . . 0.0 110.851 168.315 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 19.1 t30 -131.37 -73.17 0.53 Allowed 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 124.131 0.972 . . . . 0.0 111.064 -175.943 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -126.79 -170.07 2.14 Favored 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 123.695 0.798 . . . . 0.0 111.177 -176.152 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -145.34 35.36 1.08 Allowed 'General case' 0 N--CA 1.476 0.825 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 176.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.506 ' HA ' ' HA ' ' A' ' 51' ' ' THR . 4.5 m-20 -99.16 156.82 16.76 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.144 -177.16 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.453 ' HB2' ' O ' ' A' ' 50' ' ' THR . 5.4 t -72.01 115.66 11.5 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 86.9 m-85 -49.42 -34.66 17.02 Favored 'General case' 0 N--CA 1.495 1.823 0 C-N-CA 123.989 0.916 . . . . 0.0 112.866 -177.175 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 77.6 m-85 -91.7 -28.04 17.69 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 115.2 -0.909 . . . . 0.0 112.777 -169.617 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 7.8 p -149.61 22.72 0.9 Allowed 'General case' 0 N--CA 1.496 1.857 0 N-CA-C 113.316 0.858 . . . . 0.0 113.316 -169.155 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 65.7 mttm 71.24 -28.22 0.18 Allowed 'General case' 0 N--CA 1.505 2.277 0 N-CA-C 115.671 1.73 . . . . 0.0 115.671 172.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.453 ' O ' ' HB2' ' A' ' 45' ' ' CYS . 7.7 m -57.43 114.25 2.13 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.75 0.82 . . . . 0.0 112.268 -169.483 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.506 ' HA ' ' HA ' ' A' ' 44' ' ' ASP . 24.8 m -57.48 123.67 16.3 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 123.369 0.668 . . . . 0.0 110.508 -179.63 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.546 HG21 HG22 ' A' ' 55' ' ' VAL . 12.2 mt -71.97 122.57 24.59 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 124.86 1.264 . . . . 0.0 109.515 -175.75 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 83.9 t -81.39 -34.31 13.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 C-N-CA 122.968 0.507 . . . . 0.0 109.842 178.43 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 24.5 t -156.29 135.7 12.28 Favored 'General case' 0 C--N 1.355 0.828 0 CA-C-O 120.935 0.397 . . . . 0.0 110.596 -179.058 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.663 HG21 HG12 ' A' ' 35' ' ' ILE . 31.6 t -108.83 106.78 21.35 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 123.682 0.793 . . . . 0.0 109.881 179.871 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -93.39 141.92 27.91 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 173.45 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -79.24 118.56 21.29 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 173.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 74.1 t90 . . . . . 0 C--O 1.238 0.451 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 -175.551 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.655 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 88.0 mt . . . . . 0 CA--C 1.536 0.428 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.613 ' SG ' ' HB2' ' A' ' 30' ' ' SER . 45.2 t -59.3 118.26 28.98 Favored Pre-proline 0 CA--C 1.548 0.899 0 CA-C-O 118.357 -0.83 . . . . 0.0 108.901 173.251 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_endo -60.55 -17.37 48.18 Favored 'Trans proline' 0 N--CA 1.507 2.3 0 C-N-CA 123.111 2.54 . . . . 0.0 112.848 -176.58 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 67.8 mt -86.53 -46.2 16.55 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.871 0 C-N-CA 124.925 1.29 . . . . 0.0 111.628 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 91.9 m -92.66 -38.39 11.88 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.253 0.621 . . . . 0.0 111.564 -170.357 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.431 ' O ' HD13 ' A' ' 10' ' ' LEU . 98.1 m-85 74.69 -44.64 0.56 Allowed 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 126.232 1.813 . . . . 0.0 112.976 179.56 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -76.76 -32.49 57.76 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.268 0.627 . . . . 0.0 112.667 -175.517 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 15.6 m-70 -112.64 153.28 45.06 Favored Pre-proline 0 N--CA 1.481 1.1 0 C-N-CA 123.875 0.87 . . . . 0.0 109.52 -175.475 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.655 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 64.6 Cg_endo -79.05 -170.89 1.1 Allowed 'Trans proline' 0 C--N 1.38 2.213 0 C-N-CA 123.124 2.549 . . . . 0.0 113.9 -174.395 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.494 HG21 ' HB3' ' A' ' 29' ' ' LYS . 97.4 mt -89.99 143.18 11.72 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 CA-C-N 114.792 -1.094 . . . . 0.0 109.968 176.841 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.6 m -142.29 13.42 2.0 Allowed 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.079 0.952 . . . . 0.0 110.841 179.698 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -155.78 136.26 13.24 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.711 0.805 . . . . 0.0 110.928 -175.588 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.7 p -122.02 126.99 75.2 Favored 'Isoleucine or valine' 0 C--O 1.24 0.564 0 C-N-CA 124.605 1.162 . . . . 0.0 108.45 172.329 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -92.98 88.65 6.22 Favored 'General case' 0 C--O 1.244 0.789 0 N-CA-C 108.133 -1.062 . . . . 0.0 108.133 -178.281 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -71.56 152.35 93.77 Favored Pre-proline 0 C--O 1.242 0.704 0 CA-C-N 114.035 -1.438 . . . . 0.0 111.863 -177.506 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_endo -92.48 28.9 15.83 Favored 'Cis proline' 0 C--N 1.375 1.955 0 C-N-CA 125.783 -0.507 . . . . 0.0 112.616 -9.43 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 53.6 t -77.24 -40.31 45.33 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.258 0.623 . . . . 0.0 111.551 -176.022 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 91.73 -6.34 79.79 Favored Glycine 0 C--N 1.343 0.942 0 CA-C-O 119.37 -0.683 . . . . 0.0 114.369 179.168 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.503 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 13.5 m170 -64.95 135.51 55.75 Favored 'General case' 0 N--CA 1.481 1.084 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 167.127 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.494 ' HB3' HG21 ' A' ' 19' ' ' ILE . 86.5 mttt -136.09 151.24 49.61 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.391 0.676 . . . . 0.0 110.644 -171.126 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.613 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 92.7 p -161.9 -173.93 3.92 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.486 1.114 . . . . 0.0 108.389 172.272 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 15.8 p -75.06 145.95 41.92 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 174.308 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -67.56 -19.81 65.32 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 122.951 0.5 . . . . 0.0 111.957 -173.456 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.78 -39.53 85.21 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 123.744 0.818 . . . . 0.0 111.536 171.408 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.8 m -61.74 -49.02 78.08 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.608 0.763 . . . . 0.0 111.721 178.364 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.516 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 9.7 tp -72.14 -36.68 57.24 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 O-C-N 123.116 0.26 . . . . 0.0 111.101 -173.36 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -64.11 -38.66 91.87 Favored 'General case' 0 CA--C 1.549 0.937 0 CA-C-O 121.126 0.488 . . . . 0.0 109.843 177.611 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.508 ' O ' ' HG2' ' A' ' 40' ' ' MET . 45.9 tt0 -69.75 -27.98 65.4 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 123.961 0.905 . . . . 0.0 110.767 173.661 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 78.3 t60 -83.59 -26.57 29.9 Favored 'General case' 0 C--O 1.21 -1.007 0 C-N-CA 123.281 0.632 . . . . 0.0 111.292 -177.303 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.575 HD22 ' HG3' ' A' ' 43' ' ' LYS . 88.0 mt -69.01 -30.77 69.24 Favored 'General case' 0 N--CA 1.486 1.338 0 CA-C-N 118.314 0.506 . . . . 0.0 111.328 -177.479 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.508 ' HG2' ' O ' ' A' ' 37' ' ' GLN . 25.1 ptt? -68.28 -21.03 64.81 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 122.402 0.281 . . . . 0.0 110.53 173.871 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.47 ' ND2' HD22 ' A' ' 42' ' ' ASN . 6.6 t30 -88.3 -75.81 0.41 Allowed 'General case' 0 CA--C 1.558 1.279 0 C-N-CA 124.435 1.094 . . . . 0.0 109.412 175.34 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.47 HD22 ' ND2' ' A' ' 41' ' ' ASN . 48.4 m-80 -148.35 151.56 35.55 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 124.778 1.231 . . . . 0.0 109.673 178.162 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.575 ' HG3' HD22 ' A' ' 39' ' ' LEU . 13.5 mptt -90.63 62.04 5.03 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.592 0.757 . . . . 0.0 110.176 179.709 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -130.16 174.49 9.76 Favored 'General case' 0 N--CA 1.481 1.102 0 CA-C-O 121.423 0.63 . . . . 0.0 110.953 179.221 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.503 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 41.8 t -98.49 45.87 1.01 Allowed 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.63 1.172 . . . . 0.0 110.86 -172.45 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 57.39 -87.31 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 125.651 1.58 . . . . 0.0 113.031 172.092 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 73.0 m-85 -75.27 -37.34 60.97 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.923 1.289 . . . . 0.0 111.572 -165.288 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.47 ' HG ' ' HG1' ' A' ' 50' ' ' THR . 13.8 p -110.12 -9.43 14.71 Favored 'General case' 0 N--CA 1.482 1.153 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.432 -172.372 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 99.0 mttt 60.57 30.55 19.83 Favored 'General case' 0 N--CA 1.492 1.626 0 C-N-CA 124.502 1.121 . . . . 0.0 113.74 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.47 ' HG1' ' HG ' ' A' ' 48' ' ' CYS . 74.4 m -65.97 127.64 32.89 Favored 'General case' 0 N--CA 1.481 1.117 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 169.358 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 9.0 m -59.57 123.19 16.07 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 109.611 -0.515 . . . . 0.0 109.611 176.79 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 36.4 mm -59.51 105.7 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.929 0 O-C-N 123.757 0.661 . . . . 0.0 110.725 -176.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 35.4 t -79.28 -46.08 23.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 175.474 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 30.0 p -160.24 138.78 10.31 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.171 0.588 . . . . 0.0 111.071 176.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.5 HG11 HG21 ' A' ' 35' ' ' ILE . 65.4 t -106.66 108.5 25.31 Favored 'Isoleucine or valine' 0 C--O 1.243 0.722 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 170.564 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -104.12 147.38 27.49 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 123.322 0.649 . . . . 0.0 109.798 178.657 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -69.46 96.8 0.93 Allowed 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 178.043 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 63.4 t90 . . . . . 0 CA--C 1.543 0.701 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 -178.894 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 77.9 p . . . . . 0 N--CA 1.475 0.779 0 CA-C-O 120.685 0.279 . . . . 0.0 110.841 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 8.3 p80 -136.6 99.58 4.11 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 172.255 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 83.5 mtp -123.58 120.85 26.82 Favored Pre-proline 0 N--CA 1.482 1.169 0 C-N-CA 123.263 0.625 . . . . 0.0 109.703 -176.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -75.36 -31.37 5.82 Favored 'Trans proline' 0 C--N 1.38 2.233 0 C-N-CA 122.485 2.123 . . . . 0.0 111.691 174.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 49.3 p -86.29 103.52 14.97 Favored 'General case' 0 C--O 1.24 0.559 0 C-N-CA 124.127 0.971 . . . . 0.0 109.61 179.72 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.43 ' OG ' ' HB2' ' A' ' 10' ' ' LEU . 37.1 t -101.66 155.02 18.36 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.084 0.954 . . . . 0.0 110.335 -178.506 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -65.53 -34.0 77.24 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.56 0.744 . . . . 0.0 110.957 -178.478 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -137.6 -156.58 0.7 Allowed 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 124.43 1.092 . . . . 0.0 108.18 176.214 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -81.5 43.34 0.73 Allowed 'General case' 0 N--CA 1.484 1.238 0 CA-C-O 121.568 0.699 . . . . 0.0 110.329 171.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.675 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 93.8 mt -66.71 125.86 27.16 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.903 -173.539 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.525 ' SG ' ' HB2' ' A' ' 30' ' ' SER . 42.0 t -49.71 111.62 2.16 Favored Pre-proline 0 CA--C 1.547 0.862 0 C-N-CA 124.753 1.221 . . . . 0.0 110.211 179.589 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -62.44 -21.41 72.72 Favored 'Trans proline' 0 C--N 1.378 2.089 0 C-N-CA 123.22 2.614 . . . . 0.0 113.661 -171.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 64.9 mt -68.41 -27.54 37.07 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.153 0 C-N-CA 124.064 0.946 . . . . 0.0 111.411 176.573 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 64.6 m -125.75 -32.85 2.8 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 -164.215 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 68.03 -47.02 0.52 Allowed 'General case' 0 N--CA 1.495 1.799 0 C-N-CA 125.807 1.643 . . . . 0.0 114.068 -173.006 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -66.52 -37.76 85.73 Favored 'General case' 0 CA--C 1.55 0.946 0 N-CA-C 113.677 0.991 . . . . 0.0 113.677 -168.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 20.8 m-70 -118.77 150.88 49.25 Favored Pre-proline 0 N--CA 1.491 1.6 0 C-N-CA 123.58 0.752 . . . . 0.0 109.85 -176.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.675 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 43.9 Cg_endo -84.26 -173.35 1.51 Allowed 'Trans proline' 0 C--N 1.379 2.134 0 C-N-CA 123.042 2.495 . . . . 0.0 113.42 -178.116 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 82.8 mt -80.31 142.54 13.76 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.794 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.349 176.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.487 ' HB3' ' HG3' ' A' ' 32' ' ' LYS . 23.1 t -150.17 -4.01 0.36 Allowed 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 123.236 0.614 . . . . 0.0 111.692 177.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -137.64 132.4 32.93 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.017 0.527 . . . . 0.0 110.725 -175.104 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 12.9 p -106.05 145.85 13.47 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 C-N-CA 124.621 1.168 . . . . 0.0 109.6 174.029 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 19.7 m-85 -112.59 88.27 2.78 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.694 0.798 . . . . 0.0 109.496 -175.304 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 51.0 mt-30 -75.82 155.83 84.81 Favored Pre-proline 0 C--O 1.243 0.737 0 C-N-CA 124.078 0.951 . . . . 0.0 111.824 -176.531 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -82.32 2.21 50.62 Favored 'Cis proline' 0 N--CA 1.508 2.333 0 N-CA-C 114.585 0.956 . . . . 0.0 114.585 -2.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 41.5 t -64.44 -49.65 70.62 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.303 0.641 . . . . 0.0 112.308 -177.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 101.65 -3.1 53.14 Favored Glycine 0 CA--C 1.529 0.955 0 CA-C-O 118.47 -1.183 . . . . 0.0 114.691 178.196 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.604 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 4.4 m170 -62.74 145.04 55.75 Favored 'General case' 0 N--CA 1.492 1.67 0 CA-C-N 118.493 1.146 . . . . 0.0 110.01 175.569 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 50.8 mttp -133.34 147.91 51.85 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 122.738 0.415 . . . . 0.0 111.254 -169.254 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.525 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 88.1 p -161.19 -169.7 2.42 Favored 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 124.105 0.962 . . . . 0.0 108.971 174.045 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 17.7 p -74.42 151.96 39.56 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 122.561 0.345 . . . . 0.0 110.372 177.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.487 ' HG3' ' HB3' ' A' ' 20' ' ' SER . 28.0 mtpp -58.69 -37.77 76.8 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.141 0.576 . . . . 0.0 111.439 179.057 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -58.3 -28.64 65.2 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.51 0.724 . . . . 0.0 112.68 178.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.2 m -59.54 -62.15 2.09 Favored 'General case' 0 N--CA 1.483 1.18 0 O-C-N 123.747 0.655 . . . . 0.0 110.89 177.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.687 HG12 HG21 ' A' ' 55' ' ' VAL . 7.3 tp -66.76 -41.06 87.38 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 O-C-N 123.8 0.688 . . . . 0.0 111.447 -172.371 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -58.53 -43.65 89.3 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 122.808 0.443 . . . . 0.0 110.816 179.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -71.77 -34.84 69.8 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.39 0.676 . . . . 0.0 109.893 176.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 74.9 t60 -70.98 -28.57 64.54 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.288 1.035 . . . . 0.0 111.097 -176.47 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 94.7 mt -70.61 -11.25 60.82 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.426 0.69 . . . . 0.0 111.632 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 30.8 mmt -82.15 -14.27 55.94 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.941 0.896 . . . . 0.0 110.931 172.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 -116.09 -74.19 0.62 Allowed 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.699 1.2 . . . . 0.0 109.783 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 79.0 m-20 -125.28 -168.09 1.78 Allowed 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 124.528 1.131 . . . . 0.0 110.9 -176.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -134.66 24.59 3.7 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 124.312 1.045 . . . . 0.0 109.512 171.291 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -87.57 165.1 15.71 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-O 121.326 0.584 . . . . 0.0 111.85 -175.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.604 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 43.5 t -94.19 36.15 1.15 Allowed 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.813 1.245 . . . . 0.0 112.086 -169.557 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 54.16 -82.39 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 125.429 1.492 . . . . 0.0 113.197 169.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 41.6 m-85 -70.71 -11.99 61.28 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.119 1.368 . . . . 0.0 113.071 -169.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 15.3 p -143.14 -7.13 0.81 Allowed 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 122.87 0.468 . . . . 0.0 111.638 178.395 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 52.1 tttm 63.03 22.79 13.65 Favored 'General case' 0 CA--C 1.569 1.676 0 C-N-CA 124.496 1.118 . . . . 0.0 113.124 176.292 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 56.0 m -73.13 151.84 41.42 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.216 0.607 . . . . 0.0 110.625 174.173 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 56.6 m -63.43 120.5 11.77 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 122.605 0.362 . . . . 0.0 110.373 174.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.48 HG21 HG22 ' A' ' 55' ' ' VAL . 49.5 mt -79.9 111.38 16.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 172.681 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 87.2 t -75.57 -46.04 37.89 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 O-C-N 123.452 0.47 . . . . 0.0 109.75 176.587 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.5 m -141.91 134.4 28.16 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 122.828 0.451 . . . . 0.0 110.677 -179.268 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.687 HG21 HG12 ' A' ' 35' ' ' ILE . 41.6 t -102.3 104.12 16.01 Favored 'Isoleucine or valine' 0 C--O 1.244 0.781 0 C-N-CA 123.776 0.831 . . . . 0.0 108.888 172.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 52.8 mm-40 -105.0 156.78 17.72 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 109.843 -0.429 . . . . 0.0 109.843 179.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -78.79 108.11 11.99 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.319 175.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 53.2 t90 -74.93 112.02 10.73 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 175.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -79.29 131.15 36.06 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 174.321 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 16.5 ptpt -95.31 6.33 49.31 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.175 0.59 . . . . 0.0 111.183 178.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.315 0 CA-C-O 118.906 -0.941 . . . . 0.0 112.063 176.884 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 28.6 p . . . . . 0 N--CA 1.479 0.976 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 55.9 t-80 -95.35 126.69 40.83 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.273 0.629 . . . . 0.0 109.937 -179.239 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.403 ' SD ' ' N ' ' A' ' 3' ' ' MET . 0.0 OUTLIER -118.34 91.2 40.42 Favored Pre-proline 0 CA--C 1.561 1.395 0 C-N-CA 123.546 0.738 . . . . 0.0 110.37 179.456 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -70.84 -32.59 13.83 Favored 'Trans proline' 0 C--N 1.381 2.267 0 C-N-CA 122.63 2.22 . . . . 0.0 112.737 178.076 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 41.2 p -107.75 96.57 6.48 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.686 0.795 . . . . 0.0 109.151 174.313 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 19.3 m -91.97 53.42 2.18 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.624 0.77 . . . . 0.0 109.212 178.212 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -82.82 78.54 9.4 Favored 'General case' 0 CA--C 1.544 0.75 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.56 -171.609 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.618 ' HB3' ' HG ' ' A' ' 10' ' ' LEU . 10.2 mm-40 61.33 -178.08 0.12 Allowed 'General case' 0 CA--C 1.558 1.257 0 C-N-CA 125.364 1.465 . . . . 0.0 113.851 163.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -116.58 18.77 14.91 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.937 0.895 . . . . 0.0 108.741 172.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.703 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 58.9 mt -84.02 169.64 14.76 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.256 0.622 . . . . 0.0 111.856 -167.477 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 42.6 t -61.33 118.98 42.12 Favored Pre-proline 0 CA--C 1.549 0.936 0 CA-C-N 115.041 -0.981 . . . . 0.0 109.705 177.19 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -71.07 -3.58 13.14 Favored 'Trans proline' 0 C--N 1.379 2.182 0 C-N-CA 123.082 2.521 . . . . 0.0 113.498 -175.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 61.1 mt -91.95 -22.69 5.95 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.311 0 C-N-CA 124.367 1.067 . . . . 0.0 110.529 177.376 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 71.2 m -124.75 -51.38 1.71 Allowed 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.257 0.623 . . . . 0.0 112.073 -167.033 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 90.8 m-85 71.69 -8.83 1.02 Allowed 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 125.669 1.588 . . . . 0.0 113.587 179.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -100.4 -14.22 18.42 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 118.962 0.801 . . . . 0.0 111.513 179.022 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 85.2 m-70 -138.68 149.45 62.37 Favored Pre-proline 0 N--CA 1.485 1.296 0 C-N-CA 123.403 0.681 . . . . 0.0 109.74 177.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.703 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 64.2 Cg_endo -68.95 174.33 8.95 Favored 'Trans proline' 0 C--N 1.383 2.392 0 C-N-CA 123.422 2.748 . . . . 0.0 114.572 -177.429 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 73.2 mt -72.7 127.78 34.98 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 N-CA-C 107.718 -1.215 . . . . 0.0 107.718 167.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 51.5 p -142.65 15.27 1.97 Allowed 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.191 0.596 . . . . 0.0 111.531 -174.358 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -154.82 149.34 26.32 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.544 0.738 . . . . 0.0 110.242 -176.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.7 p -140.69 126.53 20.23 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 175.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -87.16 104.73 16.64 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.905 0.882 . . . . 0.0 109.429 -172.513 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -100.63 142.91 25.53 Favored Pre-proline 0 CA--C 1.556 1.186 0 C-N-CA 123.972 0.909 . . . . 0.0 109.587 -175.009 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.46 ' HD3' ' HB ' ' A' ' 53' ' ' VAL . 85.8 Cg_endo -96.31 89.88 0.12 OUTLIER 'Cis proline' 0 C--N 1.382 2.29 0 CA-C-N 120.073 1.062 . . . . 0.0 112.411 -1.764 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 47.8 t -142.95 -39.84 0.33 Allowed 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 116.095 -0.502 . . . . 0.0 112.056 173.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 100.88 -16.28 57.55 Favored Glycine 0 C--N 1.349 1.269 0 CA-C-O 118.96 -0.911 . . . . 0.0 114.339 175.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.584 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 11.6 m170 -59.77 134.18 56.79 Favored 'General case' 0 N--CA 1.489 1.507 0 CA-C-N 117.789 0.795 . . . . 0.0 110.266 174.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -116.57 160.23 20.96 Favored 'General case' 0 C--O 1.238 0.471 0 C-N-CA 123.814 0.846 . . . . 0.0 111.039 -173.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 45.2 t -174.4 -176.19 1.06 Allowed 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.292 1.437 . . . . 0.0 108.57 -177.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 16.1 p -89.75 151.4 21.85 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 173.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.1 -25.16 67.97 Favored 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -178.269 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.2 -41.55 88.82 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.489 0.716 . . . . 0.0 111.499 174.491 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.7 m -56.87 -56.6 19.5 Favored 'General case' 0 N--CA 1.477 0.92 0 O-C-N 124.255 0.972 . . . . 0.0 111.109 178.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.541 HG12 HG21 ' A' ' 55' ' ' VAL . 8.0 tp -69.41 -38.97 78.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 O-C-N 123.578 0.549 . . . . 0.0 110.8 -171.624 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 86.6 m-20 -62.93 -37.64 87.83 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 122.728 0.411 . . . . 0.0 110.992 176.563 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 63.8 tt0 -70.81 -34.17 71.45 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.187 0.595 . . . . 0.0 110.737 175.422 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 33.0 t60 -70.21 -34.71 73.24 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.743 0.817 . . . . 0.0 109.936 179.123 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 98.1 mt -72.83 -7.53 51.22 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.956 0.902 . . . . 0.0 111.798 -179.3 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 94.1 mmm -79.26 -16.96 55.63 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.47 0.708 . . . . 0.0 110.809 170.299 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 64.9 m-20 -116.9 -73.58 0.64 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.814 0.846 . . . . 0.0 109.644 -179.031 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -125.39 -167.26 1.66 Allowed 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 124.718 1.207 . . . . 0.0 110.328 -175.712 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 89.0 tttt -142.13 81.46 1.75 Allowed 'General case' 0 N--CA 1.476 0.866 0 CA-C-O 121.393 0.616 . . . . 0.0 109.808 178.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.45 ' HB3' ' HA ' ' A' ' 49' ' ' LYS . 15.2 m-20 -136.1 166.26 23.8 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-O 121.946 0.879 . . . . 0.0 110.89 -173.735 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.584 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 41.9 t -92.9 29.68 1.76 Allowed 'General case' 0 N--CA 1.48 1.034 0 CA-C-N 113.818 -1.537 . . . . 0.0 110.564 178.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 63.4 -85.69 0.02 OUTLIER 'General case' 0 C--N 1.358 0.953 0 C-N-CA 125.197 1.399 . . . . 0.0 112.698 172.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 43.8 m-85 -64.2 -51.82 61.88 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.579 1.152 . . . . 0.0 111.014 -166.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 20.2 p -93.19 -11.8 31.85 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.561 -178.351 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.45 ' HA ' ' HB3' ' A' ' 44' ' ' ASP . 0.1 OUTLIER 61.21 27.51 17.24 Favored 'General case' 0 N--CA 1.495 1.797 0 C-N-CA 124.987 1.315 . . . . 0.0 113.26 -176.452 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 85.5 m -65.42 118.91 10.08 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.039 0.535 . . . . 0.0 109.625 169.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 85.3 m -56.1 129.29 39.36 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.313 0.645 . . . . 0.0 110.528 179.218 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.425 HG13 HD11 ' A' ' 35' ' ' ILE . 40.2 mm -63.7 126.09 21.61 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.775 0 C-N-CA 122.971 0.508 . . . . 0.0 111.48 -174.642 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.46 ' HB ' ' HD3' ' A' ' 25' ' ' PRO . 60.9 t -97.67 -42.9 11.9 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 169.434 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.1 t -153.9 151.95 30.05 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.927 0.891 . . . . 0.0 110.255 177.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.541 HG21 HG12 ' A' ' 35' ' ' ILE . 43.1 t -124.5 122.44 63.9 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 169.83 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -93.04 150.98 20.15 Favored 'General case' 0 C--O 1.242 0.671 0 C-N-CA 122.881 0.472 . . . . 0.0 110.679 179.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -76.02 95.85 3.68 Favored 'General case' 0 C--O 1.242 0.704 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 172.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 61.4 t90 -84.92 117.62 24.03 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 -177.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -111.41 128.36 55.96 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.268 1.027 . . . . 0.0 109.532 177.7 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 27.6 ttpp -87.2 129.76 34.83 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 174.535 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.955 0 CA-C-O 118.724 -1.042 . . . . 0.0 110.922 -177.104 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 39.1 m . . . . . 0 N--CA 1.477 0.925 0 N-CA-C 110.291 -0.262 . . . . 0.0 110.291 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 45.1 t-80 -66.87 -59.31 3.64 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 123.847 0.859 . . . . 0.0 110.241 172.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 24.4 ptp -123.18 143.67 41.53 Favored Pre-proline 0 N--CA 1.476 0.865 0 C-N-CA 123.504 0.722 . . . . 0.0 109.63 178.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -81.8 128.43 5.92 Favored 'Trans proline' 0 C--N 1.372 1.782 0 C-N-CA 122.625 2.217 . . . . 0.0 111.446 171.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 49.3 p -78.72 152.96 31.26 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 123.244 0.618 . . . . 0.0 109.353 173.156 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.483 ' HB3' ' O ' ' A' ' 16' ' ' ALA . 23.3 t -157.7 118.43 3.49 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 69.46 177.86 0.26 Allowed 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 125.251 1.421 . . . . 0.0 111.509 -172.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -129.43 173.46 10.53 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 124.731 1.212 . . . . 0.0 109.443 172.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 57.12 55.38 6.04 Favored 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 -160.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.589 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 96.9 mt -69.81 142.91 53.06 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 114.192 -1.367 . . . . 0.0 112.162 -171.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.549 ' SG ' ' HB2' ' A' ' 30' ' ' SER . 47.5 t -62.58 113.22 8.29 Favored Pre-proline 0 CA--C 1.538 0.486 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 169.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -58.73 -20.29 50.43 Favored 'Trans proline' 0 C--N 1.373 1.821 0 C-N-CA 122.921 2.414 . . . . 0.0 113.894 -172.07 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.8 mp -80.93 -49.7 17.89 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.159 0 C-N-CA 123.686 0.795 . . . . 0.0 110.393 176.364 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 95.8 m -79.84 -47.57 14.93 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.23 0.612 . . . . 0.0 112.469 -170.179 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 74.66 -37.96 0.37 Allowed 'General case' 0 N--CA 1.497 1.878 0 C-N-CA 126.076 1.751 . . . . 0.0 113.14 -174.592 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.483 ' O ' ' HB3' ' A' ' 6' ' ' SER . . . -91.2 0.47 57.52 Favored 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 112.914 0.709 . . . . 0.0 112.914 -175.357 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 92.1 m-70 -146.63 151.33 42.58 Favored Pre-proline 0 N--CA 1.49 1.539 0 C-N-CA 123.833 0.853 . . . . 0.0 108.812 177.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.589 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 78.7 Cg_endo -77.49 -169.8 0.82 Allowed 'Trans proline' 0 C--N 1.378 2.087 0 C-N-CA 123.528 2.819 . . . . 0.0 114.275 -175.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 84.8 mt -85.94 155.12 3.42 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.346 0 C-N-CA 124.685 1.194 . . . . 0.0 110.732 177.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 34.8 t -141.56 -10.96 0.92 Allowed 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 124.049 0.94 . . . . 0.0 111.511 177.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -149.94 146.73 27.22 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.094 0.558 . . . . 0.0 111.605 -170.453 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.6 p -111.66 141.03 28.34 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 124.293 1.037 . . . . 0.0 110.22 175.011 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.47 ' HZ ' ' HG ' ' A' ' 30' ' ' SER . 17.7 m-85 -97.72 96.16 8.06 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.647 0.779 . . . . 0.0 108.957 176.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 36.3 mt-30 -90.26 148.83 40.06 Favored Pre-proline 0 CA--C 1.543 0.698 0 C-N-CA 123.344 0.658 . . . . 0.0 110.983 -179.273 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -88.18 13.92 50.0 Favored 'Cis proline' 0 C--N 1.38 2.197 0 N-CA-C 114.606 0.964 . . . . 0.0 114.606 4.473 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 52.2 t -67.08 -70.41 0.25 Allowed 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -173.025 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 130.4 -24.2 4.45 Favored Glycine 0 C--N 1.347 1.172 0 CA-C-O 119.487 -0.618 . . . . 0.0 113.052 -177.096 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.565 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 25.6 m170 -61.29 145.77 50.26 Favored 'General case' 0 N--CA 1.486 1.363 0 CA-C-N 117.427 0.613 . . . . 0.0 110.168 171.546 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 60.4 mttp -136.82 161.32 36.32 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.404 0.682 . . . . 0.0 111.001 -171.127 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.549 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 51.3 p -165.41 -174.47 3.19 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.201 1.0 . . . . 0.0 108.99 173.153 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 17.4 p -79.17 156.35 28.25 Favored 'General case' 0 C--O 1.246 0.898 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 173.133 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -64.41 -26.61 68.53 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.302 0.641 . . . . 0.0 112.302 -177.563 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.37 -35.35 77.21 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.063 0.545 . . . . 0.0 111.937 176.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 17.6 m -69.28 -43.73 73.3 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.306 0.642 . . . . 0.0 111.564 179.031 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.548 HG12 HG21 ' A' ' 55' ' ' VAL . 9.8 tp -75.96 -31.73 22.43 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 CA-C-O 119.662 -0.209 . . . . 0.0 110.928 -177.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 58.6 t30 -61.25 -44.81 96.63 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 174.106 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 42.6 tt0 -58.46 -44.0 89.11 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 124.76 1.224 . . . . 0.0 110.907 173.004 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 49.4 t60 -71.69 -35.22 70.19 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.492 -172.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.436 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 90.6 mt -69.61 -11.91 61.21 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.397 0.679 . . . . 0.0 112.126 -178.267 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 19.3 mmt -78.56 -14.89 59.11 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 123.87 0.868 . . . . 0.0 110.585 173.016 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 21.1 m-80 -115.98 -75.84 0.58 Allowed 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.505 1.122 . . . . 0.0 109.416 -178.213 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 49.4 m-80 -132.22 -170.93 2.52 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 124.319 1.047 . . . . 0.0 110.01 -176.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -132.68 29.41 4.18 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 123.379 0.672 . . . . 0.0 110.025 177.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.424 ' HA ' ' HA ' ' A' ' 51' ' ' THR . 23.8 m-20 -89.76 161.11 16.21 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.748 0.819 . . . . 0.0 110.992 178.477 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.565 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 40.8 t -91.7 60.43 3.97 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.195 0.598 . . . . 0.0 111.762 -175.58 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 36.0 m-85 47.71 -90.84 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 126.183 1.793 . . . . 0.0 113.922 168.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 -73.51 -56.84 4.51 Favored 'General case' 0 C--N 1.354 0.804 0 C-N-CA 123.775 0.83 . . . . 0.0 110.879 -169.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 13.1 p -77.83 -20.39 53.24 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.857 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 1.2 tmtp? 69.29 1.46 3.27 Favored 'General case' 0 CA--C 1.564 1.514 0 C-N-CA 125.133 1.373 . . . . 0.0 113.433 176.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 29.1 m -56.79 120.98 8.78 Favored 'General case' 0 CA--C 1.551 1.006 0 O-C-N 121.593 -0.692 . . . . 0.0 110.041 175.438 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.424 ' HA ' ' HA ' ' A' ' 44' ' ' ASP . 21.4 m -59.98 129.25 40.87 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.16 0.584 . . . . 0.0 111.053 -174.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.526 HG21 HG22 ' A' ' 55' ' ' VAL . 17.1 mt -81.62 127.75 39.31 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 C-N-CA 124.052 0.941 . . . . 0.0 109.552 -175.129 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 78.0 t -74.97 -50.61 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 N-CA-C 109.273 -0.639 . . . . 0.0 109.273 173.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 33.0 t -147.4 134.67 20.6 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.214 -179.3 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.548 HG21 HG12 ' A' ' 35' ' ' ILE . 44.2 t -98.87 103.03 14.19 Favored 'Isoleucine or valine' 0 C--O 1.239 0.526 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 175.073 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -91.91 169.17 10.89 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 177.091 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -82.49 150.28 27.1 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 170.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 81.6 t90 -131.55 117.44 18.76 Favored 'General case' 0 C--O 1.243 0.756 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 173.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -116.26 124.67 50.77 Favored 'General case' 0 C--O 1.243 0.721 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 170.264 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.18 152.02 17.93 Favored 'General case' 0 CA--C 1.556 1.185 0 C-N-CA 124.518 1.127 . . . . 0.0 111.9 175.656 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.343 0.959 0 CA-C-O 119.077 -0.846 . . . . 0.0 110.998 -178.753 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 31.0 m . . . . . 0 N--CA 1.475 0.776 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 13.5 p80 -84.75 132.74 34.41 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.354 0.662 . . . . 0.0 110.238 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 53.2 ttp -161.37 81.57 1.99 Allowed Pre-proline 0 CA--C 1.548 0.869 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 174.72 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -64.85 85.18 0.17 Allowed 'Trans proline' 0 C--N 1.383 2.355 0 C-N-CA 123.163 2.576 . . . . 0.0 111.757 176.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 31.6 m -88.17 84.07 6.93 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.638 -177.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 47.1 t -75.35 94.53 3.06 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 108.382 -0.969 . . . . 0.0 108.382 172.719 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -150.29 179.58 8.0 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.242 -169.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -79.87 167.88 19.97 Favored 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 123.654 0.782 . . . . 0.0 111.688 -173.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.401 ' HB3' HD12 ' A' ' 19' ' ' ILE . 9.2 m-20 -66.42 75.39 0.1 Allowed 'General case' 0 C--N 1.359 0.983 0 C-N-CA 124.762 1.225 . . . . 0.0 108.465 165.521 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.675 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 96.6 mt -79.32 152.14 30.64 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 114.204 -1.362 . . . . 0.0 110.471 -179.802 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 35.4 t -61.74 116.34 20.39 Favored Pre-proline 0 CA--C 1.545 0.762 0 O-C-N 124.032 0.832 . . . . 0.0 108.952 172.436 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -64.95 -7.66 15.82 Favored 'Trans proline' 0 C--N 1.373 1.849 0 C-N-CA 123.029 2.486 . . . . 0.0 113.476 -172.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.3 mp -90.93 -54.09 7.97 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.151 0 C-N-CA 124.096 0.958 . . . . 0.0 109.436 172.05 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 70.7 m -83.73 -58.63 2.72 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 122.958 0.503 . . . . 0.0 112.333 -171.006 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.428 ' HA ' ' HB3' ' A' ' 10' ' ' LEU . 92.1 m-85 75.3 -36.23 0.3 Allowed 'General case' 0 N--CA 1.494 1.739 0 C-N-CA 126.243 1.817 . . . . 0.0 111.996 -170.734 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.92 -27.84 67.09 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 124.322 1.049 . . . . 0.0 112.452 178.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 42.3 m80 -135.48 154.8 78.65 Favored Pre-proline 0 CA--C 1.557 1.214 0 C-N-CA 124.345 1.058 . . . . 0.0 109.977 176.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.675 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 84.7 Cg_endo -73.98 -165.08 0.24 Allowed 'Trans proline' 0 C--N 1.378 2.125 0 C-N-CA 123.361 2.707 . . . . 0.0 114.678 -175.631 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.401 HD12 ' HB3' ' A' ' 9' ' ' ASP . 83.4 mt -84.09 150.24 4.17 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.0 0 C-N-CA 124.139 0.976 . . . . 0.0 110.416 175.346 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.413 ' HB2' ' H ' ' A' ' 32' ' ' LYS . 6.9 m -138.99 -26.54 0.84 Allowed 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.752 0.821 . . . . 0.0 111.317 -178.423 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -139.7 140.08 36.74 Favored 'General case' 0 C--O 1.241 0.644 0 C-N-CA 123.608 0.763 . . . . 0.0 110.386 -174.338 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.6 p -102.89 139.93 22.53 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 C-N-CA 123.923 0.889 . . . . 0.0 109.974 175.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 10.4 m-85 -88.25 88.28 7.58 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 176.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -85.1 139.68 36.78 Favored Pre-proline 0 CA--C 1.553 1.059 0 CA-C-N 115.067 -0.97 . . . . 0.0 110.208 -172.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -95.71 15.16 39.36 Favored 'Cis proline' 0 C--N 1.386 2.519 0 N-CA-C 114.853 1.059 . . . . 0.0 114.853 4.242 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 44.7 t -59.96 -59.74 4.94 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -173.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 123.71 -28.89 5.34 Favored Glycine 0 C--N 1.344 0.998 0 CA-C-O 119.299 -0.723 . . . . 0.0 113.035 -177.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.537 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 13.7 m170 -55.26 139.49 42.29 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 171.454 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 57.9 mttp -129.94 170.62 13.71 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 123.294 0.638 . . . . 0.0 110.642 -177.453 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 47.9 t -175.3 177.19 1.9 Allowed 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.846 1.258 . . . . 0.0 108.624 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 14.3 p -77.38 153.57 33.58 Favored 'General case' 0 C--O 1.25 1.13 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 172.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.413 ' H ' ' HB2' ' A' ' 20' ' ' SER . 48.4 tttm -65.25 -29.54 70.34 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 123.252 0.621 . . . . 0.0 111.334 -173.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -58.54 -43.35 89.23 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.503 0.721 . . . . 0.0 111.49 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 10.9 m -59.27 -51.8 68.42 Favored 'General case' 0 N--CA 1.479 1.021 0 O-C-N 124.029 0.831 . . . . 0.0 111.72 178.457 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.427 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 7.6 tp -73.12 -34.73 45.87 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.779 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.131 -172.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -60.7 -43.03 98.29 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 122.523 0.329 . . . . 0.0 110.246 174.106 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 7.3 tp60 -65.72 -34.84 79.14 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.835 175.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 57.9 t60 -69.21 -43.15 74.71 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.615 0.766 . . . . 0.0 110.329 -178.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 78.7 mt -66.96 -14.54 62.94 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 124.533 1.133 . . . . 0.0 112.118 -176.735 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 96.2 mmm -64.97 -16.21 63.11 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.591 0.757 . . . . 0.0 111.422 172.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -133.92 -68.25 0.57 Allowed 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.728 0.811 . . . . 0.0 110.057 174.454 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 88.1 m-20 -106.13 157.12 17.78 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 124.104 0.961 . . . . 0.0 111.088 -172.093 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.42 ' HD2' ' N ' ' A' ' 43' ' ' LYS . 9.4 mptt -115.68 25.36 10.83 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 123.213 0.605 . . . . 0.0 109.457 179.312 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 50.3 m-20 -91.73 163.15 14.18 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 115.439 -0.8 . . . . 0.0 111.841 -172.678 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.537 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 43.5 t -93.19 50.23 1.5 Allowed 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.805 0.842 . . . . 0.0 111.301 -176.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 52.44 -84.03 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 125.561 1.544 . . . . 0.0 114.233 170.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 90.9 m-85 -73.8 -62.86 1.35 Allowed 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.126 0.97 . . . . 0.0 110.901 -170.012 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 15.9 p -75.59 -18.97 59.57 Favored 'General case' 0 N--CA 1.48 1.057 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.758 179.291 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt 66.83 13.43 9.4 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 125.073 1.349 . . . . 0.0 113.934 176.778 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 29.8 m -66.78 125.15 24.96 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 176.014 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 49.1 m -60.27 121.96 13.29 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-O 120.974 0.416 . . . . 0.0 110.214 -179.174 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 38.0 mt -72.61 133.26 32.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 C-N-CA 124.517 1.127 . . . . 0.0 109.987 -174.234 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 90.8 t -77.75 -41.97 28.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 O-C-N 123.647 0.592 . . . . 0.0 109.654 177.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 77.2 p -152.78 134.54 14.63 Favored 'General case' 0 C--O 1.242 0.699 0 C-N-CA 122.76 0.424 . . . . 0.0 110.754 176.356 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 59.8 t -87.7 104.57 14.51 Favored 'Isoleucine or valine' 0 C--O 1.244 0.796 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 170.23 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -103.0 139.46 38.54 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 -172.304 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -70.85 96.15 1.23 Allowed 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.029 0.932 . . . . 0.0 109.502 -178.533 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 88.2 t90 -82.37 128.62 34.41 Favored 'General case' 0 C--O 1.24 0.595 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.768 -177.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -133.77 141.09 47.34 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 177.226 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 62.8 mttm -61.21 -48.52 81.11 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.932 0.893 . . . . 0.0 111.889 -179.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.226 0 CA-C-O 119.175 -0.792 . . . . 0.0 112.085 -174.078 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 31.3 t . . . . . 0 N--CA 1.477 0.889 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 87.1 m-70 -93.94 89.34 6.05 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.113 0.565 . . . . 0.0 109.51 179.38 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 21.4 ptt? -149.64 80.09 7.69 Favored Pre-proline 0 CA--C 1.558 1.286 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.11 179.443 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -73.56 121.78 7.36 Favored 'Trans proline' 0 C--N 1.371 1.754 0 C-N-CA 122.264 1.976 . . . . 0.0 110.439 172.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 4.6 t -70.98 82.46 0.67 Allowed 'General case' 0 CA--C 1.553 1.068 0 CA-C-O 122.464 1.126 . . . . 0.0 110.321 -178.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 43.0 m -79.57 107.86 12.67 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 114.174 -1.375 . . . . 0.0 109.538 -177.1 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -81.55 78.51 8.29 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 123.903 0.881 . . . . 0.0 110.314 -175.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.541 ' HB2' ' HG ' ' A' ' 10' ' ' LEU . 37.2 mt-10 -132.19 -173.64 3.21 Favored 'General case' 0 C--O 1.244 0.811 0 C-N-CA 124.78 1.232 . . . . 0.0 108.179 177.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -85.36 54.94 3.29 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-O 121.752 0.787 . . . . 0.0 109.208 171.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.694 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 96.3 mt -85.43 141.7 29.77 Favored 'General case' 0 C--N 1.349 0.573 0 CA-C-N 115.123 -0.944 . . . . 0.0 109.263 177.326 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 52.1 t -58.61 115.28 11.09 Favored Pre-proline 0 CA--C 1.547 0.841 0 O-C-N 124.234 0.959 . . . . 0.0 109.847 -178.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_endo -58.71 -22.22 60.06 Favored 'Trans proline' 0 N--CA 1.502 2.027 0 C-N-CA 123.141 2.561 . . . . 0.0 113.537 -174.38 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 77.3 mt -80.5 -40.03 19.14 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.338 0 C-N-CA 124.115 0.966 . . . . 0.0 111.14 178.313 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 76.5 m -102.72 -54.48 2.64 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 123.616 0.766 . . . . 0.0 111.226 -170.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.407 ' O ' HD13 ' A' ' 10' ' ' LEU . 1.7 t80 81.9 -35.87 0.1 Allowed 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 126.616 1.966 . . . . 0.0 111.719 175.36 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.01 -33.63 70.56 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.23 0.612 . . . . 0.0 111.684 179.06 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 41.3 m170 -114.1 150.18 43.18 Favored Pre-proline 0 N--CA 1.483 1.178 0 C-N-CA 123.91 0.884 . . . . 0.0 109.321 179.132 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.694 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 49.4 Cg_endo -79.26 -165.02 0.31 Allowed 'Trans proline' 0 C--N 1.378 2.111 0 C-N-CA 122.924 2.416 . . . . 0.0 113.142 -174.267 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.498 HG21 ' HB3' ' A' ' 29' ' ' LYS . 97.9 mt -86.43 145.09 8.15 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.511 0 C-N-CA 123.946 0.898 . . . . 0.0 109.217 170.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.2 m -130.41 -19.99 3.02 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.695 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -137.68 133.77 34.64 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 122.833 0.453 . . . . 0.0 111.91 -168.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.7 p -106.57 140.78 23.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 124.833 1.253 . . . . 0.0 109.418 171.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -105.47 93.86 4.9 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.07 0.548 . . . . 0.0 110.0 -171.005 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -66.81 144.04 98.36 Favored Pre-proline 0 CA--C 1.547 0.829 0 C-N-CA 123.368 0.667 . . . . 0.0 111.144 175.677 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -85.51 0.25 63.69 Favored 'Cis proline' 0 C--N 1.377 2.035 0 N-CA-C 114.216 0.814 . . . . 0.0 114.216 -1.302 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 51.1 t -64.82 -59.74 3.87 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 -168.174 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 116.73 -16.12 13.99 Favored Glycine 0 C--N 1.346 1.129 0 CA-C-O 119.084 -0.842 . . . . 0.0 114.077 -177.311 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.67 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 9.8 m170 -63.62 161.3 15.05 Favored 'General case' 0 N--CA 1.49 1.558 0 CA-C-N 117.98 0.89 . . . . 0.0 110.515 176.15 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.498 ' HB3' HG21 ' A' ' 19' ' ' ILE . 40.3 mtmt -151.35 144.8 24.85 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 115.401 -0.818 . . . . 0.0 112.615 -161.376 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 59.8 p -156.47 -178.59 7.45 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.324 1.05 . . . . 0.0 109.006 170.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 16.8 p -72.05 162.06 30.0 Favored 'General case' 0 C--O 1.247 0.96 0 C-N-CA 122.518 0.327 . . . . 0.0 110.449 178.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 32.8 ttmt -55.94 -42.55 76.33 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.316 1.046 . . . . 0.0 110.909 177.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -56.7 -44.89 81.98 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.241 1.016 . . . . 0.0 112.465 -176.257 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 32.3 m -61.72 -54.94 35.81 Favored 'General case' 0 N--CA 1.481 1.105 0 O-C-N 123.776 0.673 . . . . 0.0 110.868 179.197 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 9.0 tp -72.54 -28.02 27.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 C-N-CA 122.796 0.438 . . . . 0.0 111.762 -172.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 50.4 t-20 -66.54 -51.78 52.8 Favored 'General case' 0 N--CA 1.486 1.325 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 178.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -69.41 -26.38 64.6 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 114.946 -1.025 . . . . 0.0 111.495 177.704 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 48.4 t60 -71.33 -41.34 69.96 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.301 0.64 . . . . 0.0 110.216 178.552 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 92.8 mt -75.08 0.2 16.89 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 123.193 0.597 . . . . 0.0 112.459 -179.006 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 86.3 mtp -80.09 -35.81 36.36 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.478 0.711 . . . . 0.0 109.317 166.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -106.28 -73.5 0.68 Allowed 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.136 0.975 . . . . 0.0 110.981 -173.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 -103.06 -168.6 1.54 Allowed 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 124.345 1.058 . . . . 0.0 110.703 -175.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.408 ' HG3' HG23 ' A' ' 51' ' ' THR . 59.6 pttt -150.55 22.33 0.81 Allowed 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.54 0.736 . . . . 0.0 109.845 176.312 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -97.84 165.39 11.96 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.796 0.838 . . . . 0.0 112.093 -174.062 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.67 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 48.9 t -91.73 39.24 1.0 Allowed 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 124.001 0.921 . . . . 0.0 111.889 -171.636 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 57.05 -84.98 0.02 OUTLIER 'General case' 0 CA--C 1.559 1.314 0 C-N-CA 125.3 1.44 . . . . 0.0 113.156 172.351 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 84.0 m-85 -78.17 -60.41 2.38 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.268 1.027 . . . . 0.0 111.474 -167.275 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 14.2 p -72.13 -21.15 61.51 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-N 117.7 0.227 . . . . 0.0 110.873 178.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 8.3 tmtt? 62.01 39.13 13.61 Favored 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 124.803 1.241 . . . . 0.0 111.019 175.284 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 25.2 m -88.63 137.09 32.64 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 166.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.408 HG23 ' HG3' ' A' ' 43' ' ' LYS . 29.1 m -68.17 120.66 14.72 Favored 'General case' 0 CA--C 1.554 1.1 0 CA-C-N 118.305 0.502 . . . . 0.0 110.406 -178.706 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 55.4 mt -67.44 131.25 33.05 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 C-N-CA 123.845 0.858 . . . . 0.0 110.115 -179.606 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 93.2 t -87.58 -40.58 13.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 122.855 0.462 . . . . 0.0 110.005 175.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.1 t -152.06 140.57 20.67 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 122.742 0.417 . . . . 0.0 110.754 -178.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 41.4 t -105.95 128.96 59.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 N-CA-C 108.739 -0.838 . . . . 0.0 108.739 175.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.5 mm-40 -118.33 157.31 27.33 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.64 1.176 . . . . 0.0 109.56 178.039 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -81.88 108.7 15.61 Favored 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 174.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 61.1 t90 -84.47 107.29 16.64 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 122.89 0.476 . . . . 0.0 109.744 178.29 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -112.41 113.51 25.74 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.351 0.661 . . . . 0.0 109.631 175.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 36.7 ttpt -80.05 117.86 21.26 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.412 0.685 . . . . 0.0 109.94 -179.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 1.617 0 CA-C-O 118.495 -1.169 . . . . 0.0 112.308 173.692 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 45.2 m . . . . . 0 N--CA 1.486 1.329 0 CA-C-O 120.576 0.227 . . . . 0.0 111.358 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 54.3 t60 -88.26 123.66 33.1 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 123.5 0.72 . . . . 0.0 111.121 -173.012 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 57.4 mtt -73.8 145.02 83.66 Favored Pre-proline 0 CA--C 1.553 1.072 0 C-N-CA 123.909 0.883 . . . . 0.0 110.946 176.433 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -53.87 92.83 0.04 OUTLIER 'Trans proline' 0 C--N 1.391 2.776 0 C-N-CA 123.906 3.071 . . . . 0.0 114.516 -172.624 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 18.7 p -138.29 -42.31 0.51 Allowed 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 125.122 1.369 . . . . 0.0 108.586 172.116 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.596 ' HB3' HD11 ' A' ' 10' ' ' LEU . 63.7 m -72.82 90.46 1.44 Allowed 'General case' 0 C--O 1.24 0.595 0 CA-C-N 115.261 -0.881 . . . . 0.0 108.94 171.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.495 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 41.6 mt-10 -62.04 131.36 49.35 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 115.087 -0.96 . . . . 0.0 110.017 -176.507 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -72.99 22.03 0.07 Allowed 'General case' 0 CA--C 1.559 1.302 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 -165.15 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -79.58 -0.3 33.0 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 124.344 1.058 . . . . 0.0 110.883 168.301 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.679 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 41.2 mt -63.32 148.63 47.81 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.106 0.962 . . . . 0.0 112.545 -174.16 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 11.8 t -58.66 108.08 1.19 Allowed Pre-proline 0 CA--C 1.549 0.935 0 CA-C-O 117.903 -1.046 . . . . 0.0 109.413 168.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -65.9 -13.16 38.53 Favored 'Trans proline' 0 C--N 1.381 2.265 0 C-N-CA 123.148 2.566 . . . . 0.0 113.237 -171.751 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 55.8 mt -67.71 -23.89 30.16 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.499 0 C-N-CA 124.03 0.932 . . . . 0.0 110.902 173.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 59.4 m -131.03 -55.09 1.05 Allowed 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 124.106 0.963 . . . . 0.0 111.235 -170.015 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 26.0 t80 75.69 28.3 0.93 Allowed 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 126.104 1.762 . . . . 0.0 109.907 178.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -104.28 -51.48 3.11 Favored 'General case' 0 CA--C 1.552 1.023 0 CA-C-N 115.469 -0.787 . . . . 0.0 112.246 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 12.2 m-70 -121.93 141.62 34.49 Favored Pre-proline 0 N--CA 1.495 1.806 0 C-N-CA 123.65 0.78 . . . . 0.0 109.948 -173.631 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.679 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 45.8 Cg_endo -84.15 47.26 2.19 Favored 'Trans proline' 0 C--N 1.386 2.539 0 C-N-CA 123.717 2.945 . . . . 0.0 114.796 -171.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.465 HG21 ' HB3' ' A' ' 29' ' ' LYS . 77.6 mt 68.21 143.63 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.352 0 C-N-CA 125.164 1.386 . . . . 0.0 112.649 172.273 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.0 t -155.11 19.9 0.43 Allowed 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 122.721 0.408 . . . . 0.0 111.144 176.091 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.474 ' HB2' ' HD2' ' A' ' 32' ' ' LYS . . . -139.97 132.23 28.24 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 122.879 0.472 . . . . 0.0 109.8 176.211 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.4 p -113.24 132.98 60.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 C-N-CA 123.486 0.714 . . . . 0.0 109.236 173.066 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 14.5 m-85 -87.84 90.49 8.4 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 -178.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -73.2 136.93 78.77 Favored Pre-proline 0 CA--C 1.553 1.089 0 CA-C-N 114.136 -1.393 . . . . 0.0 109.89 -178.215 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -98.15 20.34 26.46 Favored 'Cis proline' 0 C--N 1.374 1.911 0 N-CA-C 114.595 0.96 . . . . 0.0 114.595 -3.085 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 41.5 t -62.67 -65.6 0.66 Allowed 'General case' 0 N--CA 1.482 1.126 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -175.718 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 128.86 -25.68 4.63 Favored Glycine 0 C--N 1.35 1.347 0 CA-C-O 119.553 -0.582 . . . . 0.0 113.465 -178.001 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.647 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 26.4 m80 -63.06 147.78 49.72 Favored 'General case' 0 N--CA 1.484 1.259 0 CA-C-N 117.212 0.506 . . . . 0.0 109.64 171.077 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.465 ' HB3' HG21 ' A' ' 19' ' ' ILE . 96.1 mttt -133.95 168.92 17.9 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.926 0.89 . . . . 0.0 110.41 -173.567 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 21.2 t -168.81 177.57 4.99 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.604 0.762 . . . . 0.0 110.662 177.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 12.8 p -80.45 153.74 28.05 Favored 'General case' 0 C--O 1.246 0.876 0 CA-C-N 115.573 -0.739 . . . . 0.0 109.217 175.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.474 ' HD2' ' HB2' ' A' ' 21' ' ' ALA . 14.9 mmmm -57.96 -39.68 78.73 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.801 0.84 . . . . 0.0 112.366 -172.522 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -64.65 -35.95 82.69 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.783 0.833 . . . . 0.0 112.293 -176.246 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.8 m -59.0 -56.52 21.26 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.05 0.54 . . . . 0.0 111.238 177.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 8.4 tp -76.1 -31.32 21.42 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 CA-C-N 115.483 -0.78 . . . . 0.0 111.398 -172.115 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -63.73 -40.22 96.21 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-O 121.0 0.429 . . . . 0.0 110.465 177.138 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -76.12 -35.29 59.34 Favored 'General case' 0 CA--C 1.547 0.851 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.834 176.16 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 84.5 t60 -67.4 -42.97 82.43 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.371 0.668 . . . . 0.0 110.977 -175.277 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 67.9 mt -58.89 -23.88 61.56 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 124.234 1.013 . . . . 0.0 112.573 -177.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 55.0 mtt -66.98 -32.42 73.64 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 123.515 0.726 . . . . 0.0 110.756 176.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -100.73 -67.9 0.84 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 124.278 1.031 . . . . 0.0 110.559 179.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -124.49 156.66 36.88 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 124.019 0.928 . . . . 0.0 111.479 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 32.1 mtmm -102.45 17.47 23.5 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.247 0.619 . . . . 0.0 110.213 176.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 42.0 m-20 -88.18 151.74 22.48 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.499 0.72 . . . . 0.0 112.18 -169.151 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.647 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 39.2 t -88.64 58.7 4.78 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.658 0.783 . . . . 0.0 111.408 -177.069 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 42.97 -85.93 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 126.636 1.974 . . . . 0.0 115.094 171.347 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 53.1 m-85 -73.18 -38.23 66.24 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.384 1.074 . . . . 0.0 111.426 -165.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 16.2 p -102.63 -12.65 17.56 Favored 'General case' 0 N--CA 1.483 1.201 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.506 179.355 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.411 ' HE2' ' HB2' ' A' ' 49' ' ' LYS . 1.5 mppt? 54.26 17.74 1.6 Allowed 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 125.759 1.623 . . . . 0.0 113.691 -176.397 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 31.1 m -64.91 116.26 6.2 Favored 'General case' 0 C--N 1.35 0.594 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 174.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 13.1 m -60.13 116.15 3.99 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 122.879 0.472 . . . . 0.0 110.561 -173.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.454 HG21 HG22 ' A' ' 55' ' ' VAL . 37.6 mt -66.9 127.43 28.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 C-N-CA 124.733 1.213 . . . . 0.0 110.595 -171.537 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 29.0 t -80.89 -41.72 19.77 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.585 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 47.5 t -146.35 133.48 20.43 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.4 0.68 . . . . 0.0 109.483 177.398 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.454 HG22 HG21 ' A' ' 52' ' ' ILE . 45.9 t -98.54 104.14 15.59 Favored 'Isoleucine or valine' 0 C--O 1.245 0.853 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 172.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -91.29 143.66 26.41 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 122.785 0.434 . . . . 0.0 110.251 -178.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -76.77 108.44 9.79 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 173.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 37.6 t90 -91.83 128.3 37.61 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.79 0.836 . . . . 0.0 110.696 -176.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -87.44 122.99 31.89 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 169.631 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 34.4 tttm -85.2 -55.22 4.15 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.347 0.594 . . . . 0.0 110.769 -179.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.256 1.511 0 N-CA-C 109.869 -1.292 . . . . 0.0 109.869 -163.736 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 24.0 m . . . . . 0 C--O 1.242 0.669 0 N-CA-C 110.264 -0.272 . . . . 0.0 110.264 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 62.8 m-70 -70.91 87.78 0.73 Allowed 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 169.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 56.8 ttp -74.29 113.64 25.66 Favored Pre-proline 0 CA--C 1.549 0.924 0 CA-C-N 115.476 -0.783 . . . . 0.0 110.05 -171.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -73.48 -7.49 20.39 Favored 'Trans proline' 0 C--N 1.372 1.805 0 C-N-CA 122.822 2.348 . . . . 0.0 114.319 -172.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 75.1 p -68.15 98.51 0.8 Allowed 'General case' 0 CA--C 1.548 0.874 0 CA-C-O 121.073 0.463 . . . . 0.0 110.594 -178.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 27.1 m -75.26 -4.65 40.26 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 123.711 0.805 . . . . 0.0 111.544 178.534 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.572 ' HG3' HD21 ' A' ' 10' ' ' LEU . 10.0 pt-20 -80.02 123.69 28.05 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 123.252 0.621 . . . . 0.0 109.673 171.077 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 26.4 mm-40 -122.3 8.69 9.7 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.035 0.934 . . . . 0.0 111.212 -174.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -84.67 26.34 0.82 Allowed 'General case' 0 N--CA 1.493 1.683 0 C-N-CA 123.276 0.63 . . . . 0.0 110.767 173.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.572 HD21 ' HG3' ' A' ' 7' ' ' GLU . 35.4 mt -71.81 139.07 48.78 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.316 0.647 . . . . 0.0 111.904 -167.282 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 40.6 t -58.68 115.79 12.99 Favored Pre-proline 0 CA--C 1.549 0.937 0 CA-C-O 117.844 -1.074 . . . . 0.0 108.65 171.366 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_exo -52.56 -30.09 43.39 Favored 'Trans proline' 0 N--CA 1.506 2.212 0 C-N-CA 123.12 2.546 . . . . 0.0 114.066 -171.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.404 HD12 ' H ' ' A' ' 13' ' ' ILE . 4.2 mp -77.04 -37.72 26.86 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.072 0 C-N-CA 124.109 0.964 . . . . 0.0 110.973 -177.339 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 73.9 m -106.07 -47.34 3.86 Favored 'General case' 0 N--CA 1.485 1.28 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 -167.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.414 ' HA ' ' HB3' ' A' ' 10' ' ' LEU . 53.4 m-85 77.78 -51.89 0.52 Allowed 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 126.637 1.975 . . . . 0.0 111.638 -174.898 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.13 -5.68 14.49 Favored 'General case' 0 N--CA 1.484 1.265 0 N-CA-C 114.374 1.25 . . . . 0.0 114.374 -170.35 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 28.1 m170 -135.58 132.88 19.91 Favored Pre-proline 0 N--CA 1.483 1.218 0 C-N-CA 123.412 0.685 . . . . 0.0 109.384 172.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.561 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 42.2 Cg_endo -86.2 71.31 4.18 Favored 'Trans proline' 0 C--N 1.377 2.054 0 C-N-CA 123.46 2.773 . . . . 0.0 114.386 -173.527 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 81.9 mt 61.88 170.42 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.499 2.024 0 C-N-CA 124.27 1.028 . . . . 0.0 111.017 176.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 70.3 m -156.31 -37.91 0.08 Allowed 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 124.074 0.95 . . . . 0.0 110.188 173.337 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.413 ' HA ' ' H ' ' A' ' 58' ' ' TRP . . . -127.28 171.51 11.41 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.093 0.957 . . . . 0.0 111.24 -174.309 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 4.8 p -141.56 140.11 31.39 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 C-N-CA 124.305 1.042 . . . . 0.0 109.443 -179.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -88.3 96.4 10.56 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 124.202 1.001 . . . . 0.0 108.878 -178.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.7 tp60 -92.75 145.92 31.22 Favored Pre-proline 0 CA--C 1.555 1.137 0 CA-C-N 114.802 -1.09 . . . . 0.0 109.658 -174.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -93.59 37.53 5.92 Favored 'Cis proline' 0 C--N 1.378 2.091 0 CA-C-N 120.035 1.048 . . . . 0.0 114.431 -2.384 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 19.3 t -75.66 -78.64 0.11 Allowed 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 122.539 0.336 . . . . 0.0 111.399 176.021 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 141.44 -26.5 2.42 Favored Glycine 0 C--N 1.357 1.702 0 CA-C-O 119.724 -0.487 . . . . 0.0 113.198 -173.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.433 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 16.5 m80 -59.57 136.57 58.03 Favored 'General case' 0 N--CA 1.487 1.391 0 CA-C-N 117.144 0.472 . . . . 0.0 110.456 173.748 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -122.74 154.19 38.47 Favored 'General case' 0 C--O 1.238 0.447 0 C-N-CA 123.682 0.793 . . . . 0.0 110.445 -176.054 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 27.0 t -164.28 -168.91 1.66 Allowed 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.655 1.182 . . . . 0.0 107.842 -179.175 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 20.8 p -101.82 164.97 11.45 Favored 'General case' 0 N--CA 1.477 0.92 0 O-C-N 121.619 -0.676 . . . . 0.0 110.979 -179.465 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt -55.12 -42.84 73.47 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 124.576 1.151 . . . . 0.0 110.986 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.89 -44.84 94.01 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.743 0.817 . . . . 0.0 112.266 -177.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 7.0 m -58.57 -53.56 56.98 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 123.67 0.788 . . . . 0.0 112.195 -179.22 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 5.6 tp -70.75 -39.39 75.57 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.096 -174.22 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -61.95 -35.88 79.76 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.32 0.648 . . . . 0.0 110.858 177.488 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -73.67 -40.41 63.71 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 124.054 0.942 . . . . 0.0 110.935 176.343 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 77.2 t60 -66.61 -38.77 87.65 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.3 1.04 . . . . 0.0 111.799 -176.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 78.5 mt -62.79 -17.14 60.66 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.83 0.852 . . . . 0.0 112.91 -175.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 83.0 mtp -67.4 -31.25 71.33 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.432 0.693 . . . . 0.0 111.35 174.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 43.2 t-20 -104.38 -68.58 0.84 Allowed 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.7 m-80 -120.89 169.54 10.35 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 123.359 0.664 . . . . 0.0 111.119 -175.296 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 58.6 mmtt -111.25 10.75 21.74 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.396 0.678 . . . . 0.0 109.887 179.152 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 61.3 m-20 -85.5 163.88 18.16 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.726 0.811 . . . . 0.0 113.179 -168.766 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.433 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 42.0 t -92.75 61.14 3.55 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.467 0.707 . . . . 0.0 111.559 -176.698 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 47.37 -81.48 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 125.869 1.668 . . . . 0.0 114.298 164.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 47.7 m-85 -79.05 -46.61 17.77 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.368 1.067 . . . . 0.0 111.057 -170.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 15.5 p -100.18 -7.02 25.25 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 122.596 0.358 . . . . 0.0 111.498 -177.123 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 58.73 21.82 9.32 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 124.845 1.258 . . . . 0.0 113.623 176.149 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 29.5 m -72.91 124.77 26.1 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 174.35 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 28.5 m -60.23 115.8 3.77 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-O 120.907 0.384 . . . . 0.0 110.038 -178.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.463 HG21 HG22 ' A' ' 55' ' ' VAL . 38.7 mt -71.51 125.62 30.34 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 124.126 0.97 . . . . 0.0 110.624 -171.554 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 36.7 t -85.88 -41.47 15.32 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.774 0 C-N-CA 123.227 0.611 . . . . 0.0 109.678 -178.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 48.0 m -147.97 145.44 28.55 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.501 0.721 . . . . 0.0 110.024 178.194 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.463 HG22 HG21 ' A' ' 52' ' ' ILE . 38.3 t -115.11 104.62 17.15 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 175.4 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -88.64 144.48 26.26 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 110.065 -0.346 . . . . 0.0 110.065 179.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -73.8 103.74 4.45 Favored 'General case' 0 C--O 1.238 0.463 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 172.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.413 ' H ' ' HA ' ' A' ' 21' ' ' ALA . 53.5 t90 -72.63 94.84 1.77 Allowed 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 178.512 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -84.61 117.23 23.62 Favored 'General case' 0 C--O 1.237 0.442 0 N-CA-C 107.779 -1.193 . . . . 0.0 107.779 173.076 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 10.0 ptpp? -70.85 -17.77 62.72 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.163 0.585 . . . . 0.0 112.376 -172.022 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.954 0 CA-C-O 119.282 -0.732 . . . . 0.0 111.323 177.261 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 36.1 t . . . . . 0 N--CA 1.475 0.781 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 31.1 p80 -89.51 0.53 56.82 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.548 0.739 . . . . 0.0 111.385 177.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 20.3 ptp -113.9 93.42 29.31 Favored Pre-proline 0 CA--C 1.555 1.158 0 C-N-CA 123.48 0.712 . . . . 0.0 111.77 -171.191 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -88.96 -176.05 1.31 Allowed 'Trans proline' 0 C--N 1.377 2.074 0 C-N-CA 122.797 2.332 . . . . 0.0 111.46 169.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 6.6 t -147.84 -44.08 0.16 Allowed 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.0 0.52 . . . . 0.0 110.131 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 15.6 m -102.43 80.37 1.93 Allowed 'General case' 0 C--O 1.239 0.513 0 C-N-CA 123.826 0.85 . . . . 0.0 109.433 -178.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -70.82 94.08 1.02 Allowed 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.691 179.068 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.559 ' H ' ' HG ' ' A' ' 10' ' ' LEU . 40.2 tt0 -118.43 70.98 0.82 Allowed 'General case' 0 C--O 1.244 0.792 0 C-N-CA 123.899 0.88 . . . . 0.0 109.092 -177.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.462 ' O ' HG13 ' A' ' 19' ' ' ILE . 4.5 m-20 54.62 32.34 16.91 Favored 'General case' 0 N--CA 1.482 1.148 0 CA-C-N 114.714 -1.13 . . . . 0.0 111.685 -173.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.559 ' HG ' ' H ' ' A' ' 8' ' ' GLU . 48.2 mt -63.87 127.0 29.45 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 122.778 0.431 . . . . 0.0 111.159 -174.768 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 46.4 t -53.07 109.29 1.39 Allowed Pre-proline 0 C--N 1.352 0.685 0 O-C-N 124.375 1.047 . . . . 0.0 109.51 172.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -56.39 -31.05 83.94 Favored 'Trans proline' 0 C--N 1.373 1.832 0 C-N-CA 122.905 2.403 . . . . 0.0 113.376 -172.689 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 55.6 mt -66.56 -39.01 82.86 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.004 0 C-N-CA 124.262 1.025 . . . . 0.0 111.5 -179.383 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 82.5 m -106.87 -24.87 11.91 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.415 0.686 . . . . 0.0 112.68 -170.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 90.8 m-85 67.27 -60.44 0.37 Allowed 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 126.098 1.759 . . . . 0.0 112.86 -170.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.34 -44.13 92.69 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 114.791 1.404 . . . . 0.0 114.791 -165.241 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 54.4 m170 -104.37 150.84 38.88 Favored Pre-proline 0 N--CA 1.485 1.295 0 C-N-CA 123.179 0.591 . . . . 0.0 109.68 -175.571 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.535 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 84.0 Cg_endo -75.39 -164.42 0.24 Allowed 'Trans proline' 0 C--N 1.373 1.864 0 C-N-CA 123.049 2.5 . . . . 0.0 113.685 -179.063 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.462 HG13 ' O ' ' A' ' 9' ' ' ASP . 97.4 mt -78.91 131.59 34.05 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.638 173.776 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 38.7 t -128.13 -5.84 5.5 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.188 0.995 . . . . 0.0 110.497 179.156 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -150.68 158.24 43.92 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.273 0.629 . . . . 0.0 111.309 -176.115 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.1 p -137.64 122.91 24.85 Favored 'Isoleucine or valine' 0 C--O 1.245 0.828 0 C-N-CA 124.293 1.037 . . . . 0.0 109.016 178.122 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.0 m-30 -75.23 86.09 2.44 Favored 'General case' 0 C--O 1.241 0.606 0 CA-C-N 115.167 -0.924 . . . . 0.0 108.674 178.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 11.4 mt-30 -87.83 146.47 38.96 Favored Pre-proline 0 CA--C 1.543 0.711 0 C-N-CA 122.87 0.468 . . . . 0.0 111.203 -174.513 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_endo -92.17 17.99 40.68 Favored 'Cis proline' 0 C--N 1.371 1.734 0 C-N-CA 124.859 -0.892 . . . . 0.0 114.094 3.151 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 27.4 t -72.29 -27.5 62.5 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 111.879 0.326 . . . . 0.0 111.879 -173.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 90.74 -16.85 57.21 Favored Glycine 0 C--N 1.347 1.179 0 CA-C-O 119.357 -0.69 . . . . 0.0 114.458 175.246 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 5.9 m80 -61.94 120.06 10.05 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.15 0.58 . . . . 0.0 110.26 175.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 52.5 mttp -110.13 159.47 17.32 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.563 0.697 . . . . 0.0 111.763 -174.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 93.0 p -166.37 -164.57 0.68 Allowed 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 114.183 -1.371 . . . . 0.0 107.894 173.266 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 16.3 p -86.24 154.17 21.47 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 171.015 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -67.55 -28.81 68.11 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.214 0.606 . . . . 0.0 110.239 -175.38 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -56.95 -41.54 78.45 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.766 0.826 . . . . 0.0 112.012 175.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.8 m -55.23 -59.26 5.03 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.511 0.724 . . . . 0.0 110.994 177.419 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.712 HG21 HG11 ' A' ' 55' ' ' VAL . 10.4 tp -73.79 -22.55 18.67 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.763 0 CA-C-N 115.3 -0.863 . . . . 0.0 111.599 -173.263 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -64.49 -42.26 95.97 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 122.802 0.441 . . . . 0.0 109.853 178.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 22.7 tm0? -74.69 -34.71 62.71 Favored 'General case' 0 CA--C 1.552 1.048 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.41 176.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.502 ' HB3' HD12 ' A' ' 35' ' ' ILE . 41.5 t60 -67.21 -39.93 86.36 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.829 0.852 . . . . 0.0 111.333 -177.69 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 72.7 mt -73.99 -0.89 17.66 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 123.7 0.8 . . . . 0.0 112.82 -177.333 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 64.1 mtt -72.85 -14.31 61.47 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 123.074 0.55 . . . . 0.0 111.245 174.007 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -149.41 -57.58 0.2 Allowed 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.633 0.773 . . . . 0.0 109.621 174.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 36.4 m-20 -79.68 172.59 13.58 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.914 0.886 . . . . 0.0 110.71 -175.086 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -159.69 54.18 0.37 Allowed 'General case' 0 N--CA 1.484 1.227 0 CA-C-O 122.073 0.94 . . . . 0.0 109.204 -176.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -155.14 174.27 15.43 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.21 -172.031 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 96.9 m -70.6 137.17 49.76 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.87 172.36 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 71.0 m-85 -58.43 -36.12 73.15 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-O 121.198 0.523 . . . . 0.0 109.854 167.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -76.91 -75.23 0.21 Allowed 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 124.625 1.17 . . . . 0.0 111.705 -172.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 7.2 p -91.98 -8.25 46.66 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.136 0.575 . . . . 0.0 112.368 -170.141 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 66.56 18.3 10.76 Favored 'General case' 0 CA--C 1.572 1.803 0 C-N-CA 124.287 1.035 . . . . 0.0 111.786 178.578 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 93.6 m -78.59 129.96 35.38 Favored 'General case' 0 N--CA 1.485 1.304 0 O-C-N 121.479 -0.763 . . . . 0.0 110.593 174.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 31.2 m -59.97 134.44 57.04 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.249 1.02 . . . . 0.0 111.123 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.505 HG21 HG22 ' A' ' 55' ' ' VAL . 22.0 mt -93.24 135.49 27.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 123.355 0.662 . . . . 0.0 109.94 -177.622 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 77.2 t -79.66 -46.37 22.75 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 C-N-CA 123.106 0.562 . . . . 0.0 109.549 174.223 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 47.1 p -160.33 134.71 7.42 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.035 0.534 . . . . 0.0 110.057 179.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.712 HG11 HG21 ' A' ' 35' ' ' ILE . 36.9 t -98.21 105.16 16.88 Favored 'Isoleucine or valine' 0 C--O 1.243 0.762 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 177.807 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -86.06 143.09 28.27 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 176.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -71.3 123.94 23.4 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 172.39 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 32.4 t90 -71.75 108.34 5.02 Favored 'General case' 0 C--O 1.242 0.698 0 CA-C-O 121.081 0.467 . . . . 0.0 111.102 -171.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -76.85 152.41 35.48 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.475 170.227 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 11.9 mptt -98.51 -16.22 19.26 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.126 0.571 . . . . 0.0 111.022 -174.635 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.35 0 CA-C-O 118.85 -0.972 . . . . 0.0 113.276 177.577 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 42.4 m . . . . . 0 N--CA 1.491 1.603 0 N-CA-C 110.602 -0.147 . . . . 0.0 110.602 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 13.4 t60 -72.97 86.1 1.29 Allowed 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 176.778 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 19.7 ptp -159.79 105.31 1.44 Allowed Pre-proline 0 CA--C 1.548 0.89 0 C-N-CA 124.22 1.008 . . . . 0.0 108.999 178.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -62.79 101.31 0.26 Allowed 'Trans proline' 0 C--N 1.378 2.118 0 C-N-CA 122.631 2.22 . . . . 0.0 111.479 174.455 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 5.7 t -163.83 -30.74 0.04 OUTLIER 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 124.075 0.95 . . . . 0.0 110.487 177.527 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 40.3 m 66.62 93.2 0.07 Allowed 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 124.541 1.136 . . . . 0.0 111.435 175.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -81.56 152.5 27.21 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.604 0.762 . . . . 0.0 110.666 179.278 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -99.65 56.2 0.98 Allowed 'General case' 0 N--CA 1.484 1.263 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 171.386 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 33.8 t70 58.64 57.82 3.58 Favored 'General case' 0 N--CA 1.479 1.011 0 CA-C-O 122.673 1.225 . . . . 0.0 110.458 -175.017 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.469 HD13 ' O ' ' A' ' 15' ' ' TYR . 75.2 mt -79.79 162.24 25.22 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 114.488 -1.233 . . . . 0.0 109.612 174.8 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 52.4 t -55.04 120.75 31.54 Favored Pre-proline 0 CA--C 1.555 1.155 0 CA-C-O 118.71 -0.662 . . . . 0.0 111.241 -177.263 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -58.1 -27.76 81.09 Favored 'Trans proline' 0 C--N 1.387 2.569 0 C-N-CA 123.236 2.624 . . . . 0.0 113.248 -172.785 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.5 mp -77.49 -47.15 26.76 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.939 0 CA-C-N 114.642 -1.163 . . . . 0.0 110.331 179.09 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 74.3 m -95.61 -59.15 1.93 Allowed 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.354 0.661 . . . . 0.0 111.85 -166.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.469 ' O ' HD13 ' A' ' 10' ' ' LEU . 22.6 m-85 75.19 -39.37 0.4 Allowed 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 125.72 1.608 . . . . 0.0 113.09 -172.865 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.57 -8.43 53.98 Favored 'General case' 0 N--CA 1.486 1.341 0 CA-C-N 118.812 0.733 . . . . 0.0 112.339 -179.213 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 70.0 m80 -142.09 153.54 63.69 Favored Pre-proline 0 CA--C 1.555 1.161 0 C-N-CA 124.003 0.921 . . . . 0.0 108.639 175.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -79.09 -159.63 0.11 Allowed 'Trans proline' 0 C--N 1.382 2.335 0 C-N-CA 123.289 2.659 . . . . 0.0 113.421 -177.112 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.441 HG21 ' HB3' ' A' ' 29' ' ' LYS . 53.7 mt -98.87 133.52 41.15 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 C-N-CA 124.188 0.995 . . . . 0.0 110.095 176.415 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.406 ' H ' ' HA ' ' A' ' 31' ' ' CYS . 50.1 m -137.4 18.0 2.93 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.196 0.998 . . . . 0.0 110.593 -179.491 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.421 ' HA ' ' O ' ' A' ' 56' ' ' GLU . . . -154.09 141.03 19.25 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.182 0.593 . . . . 0.0 110.747 -176.359 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 6.9 p -123.51 133.21 69.81 Favored 'Isoleucine or valine' 0 C--O 1.241 0.607 0 C-N-CA 123.522 0.729 . . . . 0.0 109.208 173.626 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -86.96 91.24 8.62 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-N 115.182 -0.917 . . . . 0.0 108.606 -179.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -83.07 141.99 43.93 Favored Pre-proline 0 CA--C 1.552 1.023 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.389 -171.36 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_endo -97.49 23.62 23.46 Favored 'Cis proline' 0 C--N 1.377 2.031 0 CA-C-N 119.369 0.81 . . . . 0.0 113.2 -1.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 43.0 t -63.34 -55.4 24.86 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.313 0.645 . . . . 0.0 111.757 -176.101 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 117.09 -25.31 8.87 Favored Glycine 0 C--N 1.345 1.074 0 CA-C-O 119.351 -0.694 . . . . 0.0 113.681 -179.356 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.436 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 19.9 m170 -58.64 141.53 52.16 Favored 'General case' 0 N--CA 1.484 1.256 0 CA-C-N 117.43 0.615 . . . . 0.0 109.566 172.087 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.441 ' HB3' HG21 ' A' ' 19' ' ' ILE . 53.9 mttp -132.63 165.09 25.23 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.004 0.522 . . . . 0.0 110.747 -174.389 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 42.9 t -172.18 -179.87 2.43 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.258 1.423 . . . . 0.0 107.909 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.406 ' HA ' ' H ' ' A' ' 20' ' ' SER . 13.9 p -78.24 150.13 33.5 Favored 'General case' 0 C--O 1.245 0.848 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 171.912 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -60.6 -38.12 83.63 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 122.922 0.489 . . . . 0.0 111.827 -175.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.41 -32.05 69.82 Favored 'General case' 0 CA--C 1.554 1.133 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -176.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.1 m -61.33 -58.43 8.28 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 123.454 0.702 . . . . 0.0 111.139 172.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.552 HG21 HG11 ' A' ' 55' ' ' VAL . 7.0 tp -69.37 -30.4 45.62 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 O-C-N 123.285 0.366 . . . . 0.0 111.295 -173.009 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 61.0 t30 -63.38 -45.7 89.9 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 175.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -65.79 -33.57 76.16 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.853 0.861 . . . . 0.0 110.509 175.018 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.472 ' HA ' HD22 ' A' ' 41' ' ' ASN . 69.9 t60 -71.42 -32.78 68.78 Favored 'General case' 0 C--O 1.217 -0.644 0 C-N-CA 123.584 0.753 . . . . 0.0 110.372 -179.342 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.519 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 90.9 mt -66.61 -9.57 36.84 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 123.629 0.772 . . . . 0.0 111.913 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 82.2 mtp -76.69 -41.74 44.24 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 122.979 0.512 . . . . 0.0 109.732 168.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.472 HD22 ' HA ' ' A' ' 38' ' ' HIS . 23.4 m-80 -76.09 -70.41 0.44 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.039 0.935 . . . . 0.0 110.294 179.412 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 -143.87 167.39 22.44 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 125.121 1.368 . . . . 0.0 109.271 -177.242 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -98.33 21.2 11.35 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-O 121.813 0.816 . . . . 0.0 110.31 175.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -90.37 166.26 13.39 Favored 'General case' 0 CA--C 1.545 0.75 0 CA-C-O 121.811 0.815 . . . . 0.0 112.778 -173.066 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.436 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 43.6 t -96.02 54.35 1.46 Allowed 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 115.287 -0.87 . . . . 0.0 111.245 -171.662 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 49.68 -84.61 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 125.777 1.631 . . . . 0.0 113.649 174.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 40.3 m-85 -74.73 -65.4 0.87 Allowed 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.605 1.162 . . . . 0.0 109.937 -169.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 14.0 p -75.07 -17.08 60.53 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 122.535 0.334 . . . . 0.0 111.215 -177.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 52.1 mttp 65.34 23.56 12.07 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 125.299 1.44 . . . . 0.0 113.372 176.329 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 36.2 m -69.09 128.31 36.2 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 122.563 0.345 . . . . 0.0 110.173 174.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 18.0 m -62.27 110.68 1.71 Allowed 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 176.303 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 42.0 mt -70.98 135.14 28.68 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 124.131 0.972 . . . . 0.0 110.977 -172.604 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 60.1 t -78.19 -51.76 17.08 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 C-N-CA 122.97 0.508 . . . . 0.0 109.701 177.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 50.3 m -149.91 151.51 33.53 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 -179.127 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.552 HG11 HG21 ' A' ' 35' ' ' ILE . 47.6 t -121.23 110.21 27.31 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.11 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 177.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.421 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 1.6 mp0 -92.91 154.59 18.11 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 122.909 0.484 . . . . 0.0 110.785 179.517 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -67.63 96.6 0.55 Allowed 'General case' 0 C--O 1.241 0.631 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 168.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 52.9 t90 -75.79 91.65 2.97 Favored 'General case' 0 C--O 1.238 0.454 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 176.581 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -95.05 112.23 23.96 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 114.575 -1.193 . . . . 0.0 109.167 177.305 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 63.1 pttt -76.65 -18.75 58.4 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.997 0.919 . . . . 0.0 110.524 176.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.153 0 CA-C-O 118.759 -1.023 . . . . 0.0 111.343 -179.577 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 38.6 t . . . . . 0 N--CA 1.48 1.026 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 75.5 t60 -167.4 93.87 0.43 Allowed 'General case' 0 C--N 1.356 0.864 0 C-N-CA 123.259 0.623 . . . . 0.0 109.42 -179.134 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 61.2 mtt 59.33 92.6 0.06 OUTLIER Pre-proline 0 N--CA 1.486 1.351 0 C-N-CA 124.692 1.197 . . . . 0.0 111.199 178.53 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -73.42 88.25 1.02 Allowed 'Trans proline' 0 C--N 1.379 2.137 0 C-N-CA 122.853 2.369 . . . . 0.0 111.371 -171.282 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 6.3 t 47.12 25.58 0.54 Allowed 'General case' 0 N--CA 1.495 1.821 0 C-N-CA 126.087 1.755 . . . . 0.0 113.032 -178.567 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 25.7 p -69.76 148.44 49.16 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.843 0.857 . . . . 0.0 111.868 -170.749 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -73.6 147.62 43.68 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.52 179.765 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -79.51 -1.36 37.27 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.206 0.602 . . . . 0.0 111.096 175.656 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -77.86 19.68 0.39 Allowed 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 124.773 1.229 . . . . 0.0 111.84 178.624 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.665 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 79.4 mt -60.13 140.47 56.89 Favored 'General case' 0 C--N 1.349 0.575 0 C-N-CA 123.803 0.841 . . . . 0.0 111.497 178.289 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 46.0 t -59.82 119.15 38.4 Favored Pre-proline 0 CA--C 1.545 0.781 0 CA-C-O 118.208 -0.901 . . . . 0.0 108.773 172.122 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -59.81 -28.17 86.61 Favored 'Trans proline' 0 C--N 1.374 1.92 0 C-N-CA 122.586 2.191 . . . . 0.0 112.39 -175.618 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 69.6 mt -72.05 -32.61 44.36 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.099 0 C-N-CA 124.758 1.223 . . . . 0.0 112.201 -179.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 79.0 m -118.37 -50.61 2.44 Favored 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -167.091 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 80.39 -42.42 0.22 Allowed 'General case' 0 N--CA 1.498 1.946 0 C-N-CA 126.594 1.958 . . . . 0.0 112.445 -179.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.95 -33.32 71.76 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.444 0.698 . . . . 0.0 112.606 -176.343 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 11.6 m170 -125.14 155.33 71.2 Favored Pre-proline 0 N--CA 1.485 1.289 0 C-N-CA 124.099 0.96 . . . . 0.0 109.196 -179.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.665 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 95.0 Cg_endo -75.64 -163.51 0.2 Allowed 'Trans proline' 0 C--N 1.38 2.224 0 C-N-CA 122.914 2.41 . . . . 0.0 113.401 -176.332 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 86.8 mt -89.11 142.72 12.48 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 C-N-CA 123.833 0.853 . . . . 0.0 108.869 171.275 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.436 ' HB3' ' H ' ' A' ' 32' ' ' LYS . 39.7 t -129.2 -16.73 3.95 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.479 0.712 . . . . 0.0 110.785 178.687 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -145.58 133.02 20.72 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -168.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.6 p -102.5 143.07 15.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 124.892 1.277 . . . . 0.0 109.542 169.409 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 18.5 m-85 -99.13 85.62 3.27 Favored 'General case' 0 C--O 1.242 0.674 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 176.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.499 ' NE2' ' HG3' ' A' ' 56' ' ' GLU . 10.1 tt0 -82.77 143.44 46.73 Favored Pre-proline 0 CA--C 1.553 1.088 0 CA-C-N 114.157 -1.383 . . . . 0.0 108.944 -174.096 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -92.41 13.64 50.37 Favored 'Cis proline' 0 C--N 1.386 2.524 0 N-CA-C 115.925 1.471 . . . . 0.0 115.925 1.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 50.8 t -62.03 -53.78 50.8 Favored 'General case' 0 N--CA 1.484 1.251 0 CA-C-N 118.55 0.614 . . . . 0.0 111.798 -177.546 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 129.43 -43.05 1.35 Allowed Glycine 0 C--N 1.347 1.176 0 CA-C-O 119.15 -0.806 . . . . 0.0 113.297 177.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.654 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 34.5 m80 -52.16 136.01 30.79 Favored 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 123.426 0.69 . . . . 0.0 112.572 -177.361 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 6.2 mptt -118.49 168.88 10.26 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.514 0.726 . . . . 0.0 110.997 178.225 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 96.9 p -170.2 -176.07 2.14 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.068 1.347 . . . . 0.0 107.738 171.057 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 17.8 p -72.63 146.69 46.43 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 168.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.436 ' H ' ' HB3' ' A' ' 20' ' ' SER . 35.2 ttpt -70.31 -16.87 63.05 Favored 'General case' 0 N--CA 1.483 1.213 0 CA-C-O 121.079 0.466 . . . . 0.0 110.882 -175.221 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.91 -39.94 91.23 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 123.646 0.779 . . . . 0.0 111.299 170.171 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.5 m -56.42 -52.42 64.72 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.761 0.824 . . . . 0.0 111.297 178.088 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.437 HD11 HG13 ' A' ' 52' ' ' ILE . 9.7 tp -71.36 -32.78 47.89 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 O-C-N 123.398 0.436 . . . . 0.0 111.04 -174.753 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -59.13 -47.96 83.36 Favored 'General case' 0 N--CA 1.484 1.242 0 CA-C-O 121.104 0.478 . . . . 0.0 110.237 173.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -73.3 -21.61 60.54 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 115.035 -0.984 . . . . 0.0 111.699 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 46.7 t60 -77.66 -37.43 49.87 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.557 0.743 . . . . 0.0 110.163 177.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 96.1 mt -73.77 0.73 12.19 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 124.025 0.93 . . . . 0.0 111.648 179.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 23.5 mmt -78.8 -14.94 58.98 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 124.134 0.973 . . . . 0.0 110.408 169.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -134.83 -70.42 0.5 Allowed 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 123.855 0.862 . . . . 0.0 109.854 179.185 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -102.25 -174.83 2.67 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 124.064 0.946 . . . . 0.0 111.873 -174.058 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -144.93 64.82 1.28 Allowed 'General case' 0 C--N 1.349 0.587 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 175.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.472 ' HB3' ' HA ' ' A' ' 49' ' ' LYS . 18.5 m-20 -137.65 159.93 40.6 Favored 'General case' 0 N--CA 1.483 1.202 0 CA-C-O 121.736 0.779 . . . . 0.0 111.295 -169.436 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.654 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 21.8 t -94.51 37.0 1.13 Allowed 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 124.891 1.276 . . . . 0.0 111.194 -172.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 58.65 -86.32 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 125.04 1.336 . . . . 0.0 113.65 169.603 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 -87.66 44.71 1.21 Allowed 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 124.871 1.268 . . . . 0.0 112.664 -167.044 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 23.5 p 175.8 -31.96 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 126.093 1.757 . . . . 0.0 107.885 -178.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.472 ' HA ' ' HB3' ' A' ' 44' ' ' ASP . 9.9 mtmp? 63.1 38.65 10.61 Favored 'General case' 0 C--N 1.365 1.258 0 C-N-CA 125.301 1.441 . . . . 0.0 111.999 -178.017 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 8.0 m -71.97 129.21 38.0 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 166.664 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 47.9 m -57.09 131.99 51.57 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 123.093 0.557 . . . . 0.0 110.551 178.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.437 HG13 HD11 ' A' ' 35' ' ' ILE . 38.0 mm -63.09 113.43 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 123.083 0.553 . . . . 0.0 111.051 -175.118 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 75.1 t -77.13 -56.76 7.14 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 170.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 62.6 m -153.21 136.17 15.48 Favored 'General case' 0 C--O 1.246 0.903 0 C-N-CA 123.312 0.645 . . . . 0.0 111.073 177.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 59.9 t -95.26 105.01 16.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 123.973 0.909 . . . . 0.0 108.667 170.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.499 ' HG3' ' NE2' ' A' ' 24' ' ' GLN . 23.6 mm-40 -97.26 146.75 24.82 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 172.649 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -75.29 112.17 11.31 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 172.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 57.7 t90 -75.25 133.4 41.37 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 123.415 0.686 . . . . 0.0 111.218 -174.136 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -106.14 132.02 52.7 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.941 0.897 . . . . 0.0 109.042 176.038 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -81.81 106.24 13.58 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-O 120.979 0.419 . . . . 0.0 110.235 176.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.115 0 N-CA-C 110.446 -1.062 . . . . 0.0 110.446 177.272 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 21.7 m . . . . . 0 N--CA 1.479 0.982 0 CA-C-O 120.286 0.089 . . . . 0.0 110.908 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 73.4 m80 -80.38 167.1 20.63 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 123.197 0.599 . . . . 0.0 111.651 -179.204 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.451 ' HA ' ' HD3' ' A' ' 4' ' ' PRO . 88.2 mtp -83.62 130.12 57.1 Favored Pre-proline 0 CA--C 1.55 0.956 0 C-N-CA 123.464 0.706 . . . . 0.0 110.074 176.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.451 ' HD3' ' HA ' ' A' ' 3' ' ' MET . 31.4 Cg_exo -61.66 -19.46 65.15 Favored 'Trans proline' 0 C--N 1.384 2.444 0 C-N-CA 123.494 2.796 . . . . 0.0 114.684 -175.606 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 25.3 m 70.25 159.95 0.2 Allowed 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.565 1.146 . . . . 0.0 110.618 -177.539 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 12.3 p -57.38 135.99 56.57 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.189 0.596 . . . . 0.0 110.465 171.526 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -68.23 -56.0 10.24 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.388 0.675 . . . . 0.0 111.546 -172.138 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.732 ' HB2' ' HG ' ' A' ' 10' ' ' LEU . 39.8 mt-10 53.39 -152.1 0.31 Allowed 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 124.6 1.16 . . . . 0.0 111.564 175.156 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -96.3 27.55 3.68 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.296 0.638 . . . . 0.0 109.805 167.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.732 ' HG ' ' HB2' ' A' ' 8' ' ' GLU . 85.1 mt -68.05 145.0 54.85 Favored 'General case' 0 C--N 1.352 0.68 0 C-N-CA 123.223 0.609 . . . . 0.0 111.197 -178.826 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 41.2 t -60.32 118.66 35.65 Favored Pre-proline 0 CA--C 1.545 0.77 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.486 173.85 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -65.92 -15.16 47.8 Favored 'Trans proline' 0 N--CA 1.5 1.877 0 C-N-CA 122.549 2.166 . . . . 0.0 113.013 -174.352 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 43.8 mt -85.96 -20.06 8.15 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.205 0 C-N-CA 124.478 1.111 . . . . 0.0 111.034 -178.462 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 39.8 m -134.39 -51.62 0.81 Allowed 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -169.679 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 78.95 -40.08 0.24 Allowed 'General case' 0 N--CA 1.498 1.954 0 C-N-CA 126.194 1.798 . . . . 0.0 112.981 -178.345 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.18 -14.66 56.73 Favored 'General case' 0 CA--C 1.559 1.3 0 N-CA-C 113.121 0.786 . . . . 0.0 113.121 -177.083 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 57.7 m-70 -137.77 150.36 67.6 Favored Pre-proline 0 N--CA 1.485 1.288 0 C-N-CA 124.049 0.94 . . . . 0.0 109.458 172.123 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.656 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 87.6 Cg_endo -76.02 -165.7 0.32 Allowed 'Trans proline' 0 C--N 1.382 2.341 0 C-N-CA 123.144 2.563 . . . . 0.0 113.762 178.107 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 65.9 mt -78.29 149.28 5.83 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.93 0 C-N-CA 123.448 0.699 . . . . 0.0 110.445 175.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.6 m -136.13 -32.65 0.86 Allowed 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.628 0.771 . . . . 0.0 111.079 -179.213 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -130.21 152.9 49.14 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.547 0.739 . . . . 0.0 111.584 -170.26 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.47 HG13 HE22 ' A' ' 24' ' ' GLN . 7.2 p -128.53 138.69 53.94 Favored 'Isoleucine or valine' 0 C--O 1.244 0.771 0 C-N-CA 124.828 1.251 . . . . 0.0 108.29 176.066 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 19.0 m-85 -107.27 105.62 15.68 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.094 0.558 . . . . 0.0 110.782 -169.305 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.47 HE22 HG13 ' A' ' 22' ' ' VAL . 2.9 mp0 -82.6 149.37 60.57 Favored Pre-proline 0 N--CA 1.474 0.735 0 C-N-CA 123.976 0.91 . . . . 0.0 110.469 174.804 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -97.15 81.64 0.13 OUTLIER 'Cis proline' 0 C--N 1.369 1.619 0 CA-C-N 118.853 0.626 . . . . 0.0 110.871 -3.304 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 36.6 t -143.11 -64.52 0.4 Allowed 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.861 -0.609 . . . . 0.0 112.127 -175.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 114.96 -12.03 20.28 Favored Glycine 0 C--N 1.345 1.032 0 CA-C-O 118.884 -0.953 . . . . 0.0 113.79 -176.576 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.424 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 6.1 m170 -58.31 139.42 55.25 Favored 'General case' 0 N--CA 1.491 1.606 0 CA-C-N 118.17 0.985 . . . . 0.0 110.207 171.541 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 57.4 mttp -130.41 156.28 45.0 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.318 0.647 . . . . 0.0 110.729 -174.136 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 92.9 p -169.0 -179.39 3.62 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.27 1.028 . . . . 0.0 109.11 174.028 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 13.6 p -69.04 148.91 49.37 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 173.331 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -71.03 -18.16 62.59 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-N 117.859 0.3 . . . . 0.0 111.667 -174.53 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.17 -34.38 74.95 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 122.369 0.268 . . . . 0.0 111.47 171.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.7 m -60.86 -51.72 68.11 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.496 0.718 . . . . 0.0 111.243 177.223 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.426 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 10.0 tp -71.33 -31.81 44.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 O-C-N 123.236 0.335 . . . . 0.0 110.849 -176.67 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 4.7 t30 -60.93 -46.49 90.46 Favored 'General case' 0 N--CA 1.48 1.05 0 CA-C-O 121.288 0.566 . . . . 0.0 109.967 174.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 63.7 tt0 -72.09 -27.12 62.45 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.083 178.537 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 47.3 t60 -77.17 -39.24 49.7 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 122.802 0.441 . . . . 0.0 110.674 -177.777 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 69.6 mt -66.33 -25.44 66.82 Favored 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 112.828 0.677 . . . . 0.0 112.828 -173.276 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 26.6 ptm -75.19 -14.15 60.52 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 122.541 0.336 . . . . 0.0 111.482 175.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 46.1 m-80 -105.87 -67.22 0.94 Allowed 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.203 0.601 . . . . 0.0 110.401 175.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 41.5 m-80 -132.17 -168.37 2.03 Favored 'General case' 0 N--CA 1.49 1.537 0 C-N-CA 124.871 1.268 . . . . 0.0 110.75 -176.054 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 82.4 tttt -135.62 9.41 3.38 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 123.389 0.675 . . . . 0.0 110.776 176.55 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.413 ' HB2' ' HA ' ' A' ' 49' ' ' LYS . 3.7 p30 -74.64 167.61 21.44 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-O 121.336 0.588 . . . . 0.0 111.372 -179.444 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.424 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 53.5 t -90.24 52.75 2.31 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.561 0.744 . . . . 0.0 110.877 -177.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 35.6 m-85 54.97 -80.25 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 126.084 1.754 . . . . 0.0 113.262 172.644 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 48.8 m-85 -83.58 -62.69 1.51 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.334 1.054 . . . . 0.0 110.732 -172.214 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 9.4 p -80.34 -7.95 59.29 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 122.829 0.451 . . . . 0.0 111.959 -173.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.413 ' HA ' ' HB2' ' A' ' 44' ' ' ASP . 74.4 mmtt 67.99 11.52 8.4 Favored 'General case' 0 N--CA 1.484 1.27 0 N-CA-C 114.583 1.327 . . . . 0.0 114.583 172.686 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 39.3 m -64.12 136.35 57.18 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 122.886 0.474 . . . . 0.0 111.025 176.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 90.0 m -63.06 119.91 10.42 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 122.861 0.464 . . . . 0.0 110.305 176.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.416 HD11 ' HA ' ' A' ' 45' ' ' CYS . 53.3 mt -79.13 104.29 6.96 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.797 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 -178.531 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 88.0 t -75.05 -31.38 24.85 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.818 0 C-N-CA 123.722 0.809 . . . . 0.0 110.735 177.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.3 t -151.7 134.18 15.39 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-O 120.678 0.275 . . . . 0.0 111.036 179.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 59.3 t -105.11 103.42 15.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 171.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -109.28 146.04 34.94 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.094 0.558 . . . . 0.0 110.556 -175.317 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -72.09 106.69 4.43 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.239 0.616 . . . . 0.0 110.347 -177.61 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 60.3 t90 -81.12 112.49 18.53 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 176.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -107.66 119.57 39.8 Favored 'General case' 0 C--O 1.239 0.55 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 174.651 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -70.48 -47.89 58.38 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.165 0.507 . . . . 0.0 110.23 -178.829 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.85 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.772 -177.733 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 43.2 m . . . . . 0 N--CA 1.487 1.39 0 CA-C-O 120.286 0.089 . . . . 0.0 110.869 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 65.9 m-70 60.31 91.38 0.05 Allowed 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.869 1.268 . . . . 0.0 111.428 -177.478 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 38.9 mtm -80.18 120.65 80.27 Favored Pre-proline 0 CA--C 1.55 0.975 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 174.105 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_exo -67.37 147.72 78.32 Favored 'Trans proline' 0 C--N 1.376 1.981 0 C-N-CA 122.339 2.026 . . . . 0.0 112.043 178.117 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.7 m 69.63 13.82 8.21 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 124.943 1.297 . . . . 0.0 111.621 178.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 68.5 m -76.81 -47.72 20.65 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 122.907 0.483 . . . . 0.0 109.748 174.043 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 56.92 -164.43 0.16 Allowed 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 124.469 1.108 . . . . 0.0 111.816 174.44 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.686 ' HB3' ' HG ' ' A' ' 10' ' ' LEU . 7.8 tp10 66.81 176.32 0.24 Allowed 'General case' 0 CA--C 1.56 1.353 0 C-N-CA 124.077 0.951 . . . . 0.0 111.312 172.41 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -83.28 39.2 0.64 Allowed 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.306 0.642 . . . . 0.0 110.448 169.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.686 ' HG ' ' HB3' ' A' ' 8' ' ' GLU . 63.1 mt -59.65 120.95 10.43 Favored 'General case' 0 C--N 1.354 0.803 0 C-N-CA 123.012 0.525 . . . . 0.0 110.755 -179.259 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.576 ' SG ' ' HB2' ' A' ' 30' ' ' SER . 43.0 t -47.38 112.0 1.87 Allowed Pre-proline 0 N--CA 1.476 0.857 0 C-N-CA 125.291 1.436 . . . . 0.0 110.617 -177.009 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -60.25 -16.66 41.98 Favored 'Trans proline' 0 N--CA 1.506 2.264 0 C-N-CA 123.041 2.494 . . . . 0.0 114.085 -169.137 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 68.4 mt -81.26 -43.13 20.27 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.108 0 C-N-CA 124.052 0.941 . . . . 0.0 110.787 177.16 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 93.1 m -97.69 -41.87 7.9 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 123.864 0.866 . . . . 0.0 112.498 -168.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 75.48 -46.45 0.57 Allowed 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 126.756 2.022 . . . . 0.0 112.333 -176.113 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.05 -37.38 87.38 Favored 'General case' 0 N--CA 1.484 1.256 0 N-CA-C 113.75 1.018 . . . . 0.0 113.75 -173.376 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 44.5 m170 -121.44 152.82 58.52 Favored Pre-proline 0 N--CA 1.484 1.26 0 C-N-CA 123.479 0.711 . . . . 0.0 109.521 -177.734 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.606 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 49.4 Cg_endo -82.4 -170.28 0.91 Allowed 'Trans proline' 0 C--N 1.379 2.151 0 C-N-CA 123.138 2.559 . . . . 0.0 114.243 -175.273 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.413 HG21 ' HB3' ' A' ' 29' ' ' LYS . 88.8 mt -81.38 140.24 16.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 123.674 0.79 . . . . 0.0 109.965 178.693 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.0 m -140.64 3.85 1.9 Allowed 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.224 0.61 . . . . 0.0 111.276 -177.104 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -152.92 157.27 40.39 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.116 0.566 . . . . 0.0 112.199 -171.131 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.9 p -135.06 140.27 45.57 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 C-N-CA 124.301 1.041 . . . . 0.0 109.185 174.249 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -99.94 99.45 10.22 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.79 0.836 . . . . 0.0 110.704 -173.459 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -72.59 146.94 89.15 Favored Pre-proline 0 N--CA 1.481 1.109 0 C-N-CA 123.845 0.858 . . . . 0.0 111.559 173.303 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 15.8 Cg_endo -95.24 28.41 17.22 Favored 'Cis proline' 0 C--N 1.377 2.027 0 C-N-CA 125.561 -0.6 . . . . 0.0 112.022 -3.621 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 36.9 t -81.36 -74.81 0.31 Allowed 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.447 0.699 . . . . 0.0 111.611 -176.041 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 136.2 -21.93 3.44 Favored Glycine 0 C--N 1.351 1.381 0 CA-C-O 119.362 -0.688 . . . . 0.0 113.927 -177.31 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.411 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 13.4 m170 -58.93 142.83 49.79 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 123.077 0.551 . . . . 0.0 111.174 178.632 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.413 ' HB3' HG21 ' A' ' 19' ' ' ILE . 53.7 mttm -129.35 145.64 51.35 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.62 0.768 . . . . 0.0 110.817 -169.526 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.576 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 96.0 p -165.65 -177.3 4.29 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.51 1.124 . . . . 0.0 108.389 173.572 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 14.1 p -66.25 142.83 57.55 Favored 'General case' 0 N--CA 1.478 0.935 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 172.17 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -62.69 -29.88 70.98 Favored 'General case' 0 N--CA 1.487 1.381 0 CA-C-N 117.888 0.313 . . . . 0.0 111.57 -177.288 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -53.85 -30.52 45.82 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.419 1.088 . . . . 0.0 112.633 176.272 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.3 m -59.28 -56.87 16.56 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.702 0.801 . . . . 0.0 111.11 175.758 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.562 HG21 HG11 ' A' ' 55' ' ' VAL . 8.3 tp -76.53 -21.71 15.09 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.68 0 O-C-N 123.351 0.407 . . . . 0.0 110.918 -174.725 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -66.03 -41.78 90.46 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 173.305 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -69.97 -40.78 75.17 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.397 0.679 . . . . 0.0 110.623 173.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.462 ' HB3' HD12 ' A' ' 35' ' ' ILE . 78.5 t60 -70.79 -34.32 71.66 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.97 -172.691 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 54.3 mt -71.06 -10.94 60.61 Favored 'General case' 0 N--CA 1.494 1.749 0 CA-C-N 118.364 0.529 . . . . 0.0 112.277 179.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 52.8 mtt -77.18 -17.4 58.58 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.381 0.673 . . . . 0.0 110.227 170.568 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 30.1 t30 -112.28 -75.12 0.61 Allowed 'General case' 0 CA--C 1.558 1.284 0 C-N-CA 124.929 1.292 . . . . 0.0 110.388 179.338 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -127.27 173.65 9.58 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 124.246 1.018 . . . . 0.0 110.961 -176.785 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -112.04 18.59 18.61 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 122.905 0.482 . . . . 0.0 111.556 -176.65 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -96.16 165.71 12.1 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-O 121.4 0.619 . . . . 0.0 112.595 -169.454 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.411 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 53.2 t -94.62 46.05 1.13 Allowed 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.791 0.836 . . . . 0.0 111.69 -174.843 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 77.5 m-85 54.19 -82.9 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 125.908 1.683 . . . . 0.0 113.54 172.524 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -71.49 -63.12 1.18 Allowed 'General case' 0 C--N 1.348 0.51 0 C-N-CA 124.32 1.048 . . . . 0.0 110.436 -171.726 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 14.6 p -79.74 -14.54 58.65 Favored 'General case' 0 N--CA 1.484 1.233 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.282 -176.254 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 88.8 mttt 64.31 14.98 9.14 Favored 'General case' 0 N--CA 1.494 1.74 0 C-N-CA 124.996 1.318 . . . . 0.0 113.518 175.681 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 16.8 m -67.77 121.91 16.97 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 174.668 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 35.2 m -62.72 117.37 6.21 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-O 121.198 0.523 . . . . 0.0 110.187 -179.102 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 57.9 mt -72.46 129.88 35.63 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 C-N-CA 124.669 1.188 . . . . 0.0 111.132 -173.282 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 76.3 t -79.62 -55.39 9.33 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 172.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.9 m -137.54 144.91 42.34 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.396 0.678 . . . . 0.0 110.284 -173.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.562 HG11 HG21 ' A' ' 35' ' ' ILE . 56.1 t -117.05 119.07 60.85 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 N-CA-C 108.493 -0.928 . . . . 0.0 108.493 171.389 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -99.92 168.32 9.95 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 122.999 0.52 . . . . 0.0 110.525 174.362 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -93.69 101.03 13.15 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 174.223 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 29.8 t90 -73.22 109.62 6.89 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-O 120.87 0.367 . . . . 0.0 110.955 -174.092 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -74.08 148.89 41.47 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.114 0.965 . . . . 0.0 109.339 171.824 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.42 178.71 5.34 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.287 1.035 . . . . 0.0 109.882 -171.691 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.256 1.51 0 CA-C-O 118.812 -0.993 . . . . 0.0 112.454 176.644 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 20.3 m . . . . . 0 N--CA 1.47 0.567 0 N-CA-C 111.202 0.075 . . . . 0.0 111.202 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -137.16 142.34 42.21 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.96 0.904 . . . . 0.0 109.876 -178.746 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 57.3 ttm -99.15 134.57 21.24 Favored Pre-proline 0 N--CA 1.48 1.074 0 C-N-CA 123.892 0.877 . . . . 0.0 108.991 176.641 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -56.21 103.3 0.11 Allowed 'Trans proline' 0 C--N 1.387 2.57 0 C-N-CA 122.891 2.394 . . . . 0.0 111.96 176.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 26.8 p -77.24 83.57 3.71 Favored 'General case' 0 CA--C 1.547 0.855 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.37 -175.314 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.548 ' HB3' HD12 ' A' ' 10' ' ' LEU . 52.7 m -82.83 126.53 32.54 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 115.052 -0.976 . . . . 0.0 110.014 178.281 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -95.94 33.55 1.68 Allowed 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 124.009 0.923 . . . . 0.0 111.005 -175.053 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -153.06 167.32 29.61 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.806 0.842 . . . . 0.0 109.22 -175.27 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -79.83 58.29 2.8 Favored 'General case' 0 N--CA 1.485 1.301 0 CA-C-O 122.704 1.24 . . . . 0.0 111.177 176.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.548 HD12 ' HB3' ' A' ' 6' ' ' SER . 81.4 mt -82.6 171.95 13.49 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-N 114.618 -1.174 . . . . 0.0 109.634 174.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.452 ' SG ' ' HB2' ' A' ' 30' ' ' SER . 51.9 t -56.52 112.57 4.63 Favored Pre-proline 0 N--CA 1.484 1.251 0 CA-C-O 118.74 -0.647 . . . . 0.0 110.079 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -61.08 -17.18 50.53 Favored 'Trans proline' 0 C--N 1.377 2.078 0 C-N-CA 123.307 2.671 . . . . 0.0 113.375 -172.257 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 68.9 mt -84.55 -48.45 16.71 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.064 0 C-N-CA 124.031 0.932 . . . . 0.0 110.906 176.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 90.1 m -86.41 -53.24 5.12 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.152 0.581 . . . . 0.0 111.801 -171.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 78.39 -40.32 0.28 Allowed 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 126.515 1.926 . . . . 0.0 112.329 -175.303 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -78.0 -10.71 59.73 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 113.093 0.775 . . . . 0.0 113.093 -176.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -139.96 154.31 70.4 Favored Pre-proline 0 N--CA 1.483 1.206 0 C-N-CA 123.851 0.86 . . . . 0.0 109.383 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.526 ' HB2' ' HG3' ' A' ' 60' ' ' LYS . 82.0 Cg_endo -77.15 -173.69 1.89 Allowed 'Trans proline' 0 C--N 1.38 2.192 0 C-N-CA 123.045 2.497 . . . . 0.0 114.232 -174.334 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.512 HG21 ' HB3' ' A' ' 29' ' ' LYS . 67.5 mt -89.27 143.33 11.39 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.807 0 CA-C-N 114.767 -1.106 . . . . 0.0 109.659 175.586 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 78.4 p -150.13 19.73 0.87 Allowed 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.134 0.573 . . . . 0.0 111.195 179.683 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -158.38 138.42 12.27 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.477 0.711 . . . . 0.0 110.704 -178.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 10.5 p -116.69 139.93 41.36 Favored 'Isoleucine or valine' 0 C--O 1.245 0.824 0 C-N-CA 124.096 0.958 . . . . 0.0 109.213 171.069 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 15.0 m-85 -97.46 86.7 3.93 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 176.733 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.523 ' HG3' ' HA ' ' A' ' 25' ' ' PRO . 8.5 tt0 -91.21 140.98 25.87 Favored Pre-proline 0 CA--C 1.553 1.084 0 N-CA-C 108.358 -0.978 . . . . 0.0 108.358 -173.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.523 ' HA ' ' HG3' ' A' ' 24' ' ' GLN . 12.0 Cg_endo -94.09 22.82 28.16 Favored 'Cis proline' 0 C--N 1.387 2.583 0 N-CA-C 116.246 1.595 . . . . 0.0 116.246 7.609 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 35.3 t -68.52 -63.91 0.97 Allowed 'General case' 0 N--CA 1.481 1.08 0 CA-C-N 118.315 0.507 . . . . 0.0 111.572 178.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 124.82 -25.5 5.84 Favored Glycine 0 C--N 1.35 1.312 0 CA-C-O 119.323 -0.71 . . . . 0.0 113.17 -177.222 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.415 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 10.0 m170 -56.15 140.01 45.59 Favored 'General case' 0 N--CA 1.49 1.574 0 CA-C-N 117.25 0.525 . . . . 0.0 110.498 173.87 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.512 ' HB3' HG21 ' A' ' 19' ' ' ILE . 61.2 mttp -133.99 151.42 51.45 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.905 0.882 . . . . 0.0 110.634 -173.429 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.452 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 89.1 p -164.51 -173.86 3.22 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.82 1.248 . . . . 0.0 107.842 173.606 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.42 ' SG ' ' HB3' ' A' ' 33' ' ' ALA . 20.0 p -79.12 149.99 31.89 Favored 'General case' 0 C--O 1.244 0.766 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 173.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 63.2 pttt -65.6 -18.1 65.07 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.161 0.584 . . . . 0.0 112.169 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.42 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . . . -62.13 -40.75 96.98 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 123.318 0.647 . . . . 0.0 111.332 172.515 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.8 m -59.52 -52.8 64.01 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.618 0.767 . . . . 0.0 111.174 179.273 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.567 HG21 HG11 ' A' ' 55' ' ' VAL . 9.3 tp -73.18 -32.89 40.15 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.708 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.99 -174.41 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -61.47 -44.95 96.19 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-O 121.014 0.435 . . . . 0.0 109.986 177.567 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -60.15 -40.29 89.36 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 114.784 -1.098 . . . . 0.0 110.974 173.693 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 73.0 t60 -73.85 -33.15 63.99 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 114.759 -1.109 . . . . 0.0 111.698 -174.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 78.8 mt -71.79 -9.13 57.86 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 123.521 0.729 . . . . 0.0 112.102 -176.522 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 17.5 mmt -74.72 -24.6 58.76 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 123.18 0.592 . . . . 0.0 109.747 172.274 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 39.2 t30 -111.34 -73.13 0.69 Allowed 'General case' 0 CA--C 1.555 1.141 0 C-N-CA 124.532 1.133 . . . . 0.0 110.344 -178.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -120.71 -175.17 2.97 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 123.976 0.91 . . . . 0.0 111.15 -175.434 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt -136.63 20.25 3.1 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 123.831 0.852 . . . . 0.0 109.6 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -85.85 164.13 17.7 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 121.291 0.567 . . . . 0.0 110.868 -177.789 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.415 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 53.5 t -91.39 38.65 0.98 Allowed 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.067 0.947 . . . . 0.0 111.97 -173.165 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 57.43 -84.66 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 125.756 1.622 . . . . 0.0 112.627 171.416 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 -67.64 -50.43 58.02 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.593 1.157 . . . . 0.0 110.644 -169.222 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 14.7 p -97.63 -7.85 30.17 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.387 -177.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt 59.94 13.19 3.51 Favored 'General case' 0 CA--C 1.57 1.744 0 C-N-CA 125.506 1.522 . . . . 0.0 114.299 177.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 55.7 m -64.32 134.17 54.13 Favored 'General case' 0 N--CA 1.479 0.979 0 O-C-N 121.249 -0.907 . . . . 0.0 110.44 176.703 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 25.6 m -63.11 112.54 2.68 Favored 'General case' 0 C--O 1.245 0.868 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 177.75 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.503 HG21 HG22 ' A' ' 55' ' ' VAL . 30.5 mt -69.49 124.02 24.44 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 O-C-N 123.728 0.642 . . . . 0.0 109.825 -174.737 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 89.7 t -71.01 -51.31 36.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 O-C-N 123.705 0.628 . . . . 0.0 109.799 177.15 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 36.2 p -143.34 133.18 23.98 Favored 'General case' 0 C--O 1.249 1.026 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.703 178.595 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.567 HG11 HG21 ' A' ' 35' ' ' ILE . 23.3 t -102.04 106.97 20.69 Favored 'Isoleucine or valine' 0 C--N 1.348 0.528 0 N-CA-C 107.933 -1.136 . . . . 0.0 107.933 174.355 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -115.7 157.4 24.32 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.63 0.772 . . . . 0.0 110.215 -174.059 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -77.96 128.1 33.39 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.479 ' CZ3' ' HA ' ' A' ' 60' ' ' LYS . 74.7 t90 -114.19 105.04 12.71 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 175.526 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -61.23 124.98 22.11 Favored 'General case' 0 C--O 1.242 0.686 0 C-N-CA 123.311 0.644 . . . . 0.0 109.373 173.687 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.526 ' HG3' ' HB2' ' A' ' 18' ' ' PRO . 11.9 tmtt? -66.47 -59.17 3.91 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.851 0.86 . . . . 0.0 110.895 -169.374 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.986 0 CA-C-O 118.771 -1.016 . . . . 0.0 112.839 -179.48 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 54.5 p . . . . . 0 N--CA 1.481 1.095 0 CA-C-O 120.62 0.248 . . . . 0.0 110.773 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 4.7 p80 -80.65 158.35 25.67 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.348 0.659 . . . . 0.0 110.264 176.327 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 15.7 ptm -149.66 74.82 9.45 Favored Pre-proline 0 CA--C 1.554 1.134 0 C-N-CA 123.682 0.793 . . . . 0.0 109.614 -175.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_exo -65.17 -49.08 2.91 Favored 'Trans proline' 0 C--N 1.381 2.253 0 C-N-CA 122.92 2.413 . . . . 0.0 112.174 -177.442 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 18.1 p -118.46 98.52 6.3 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.737 1.215 . . . . 0.0 109.426 -177.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 64.8 m -133.38 104.42 6.42 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.788 0.835 . . . . 0.0 109.023 179.14 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -116.26 -77.63 0.57 Allowed 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 -178.03 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -170.55 172.92 5.71 Favored 'General case' 0 C--O 1.247 0.937 0 C-N-CA 125.111 1.365 . . . . 0.0 108.733 175.285 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 58.17 36.24 25.67 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 124.164 0.986 . . . . 0.0 109.76 -172.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.621 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 90.2 mt -74.95 139.9 43.33 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.404 0.682 . . . . 0.0 110.097 -176.92 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 50.5 t -57.95 115.05 9.85 Favored Pre-proline 0 CA--C 1.548 0.901 0 O-C-N 123.874 0.734 . . . . 0.0 109.794 178.455 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_endo -57.45 -18.11 30.22 Favored 'Trans proline' 0 N--CA 1.508 2.335 0 C-N-CA 123.505 2.803 . . . . 0.0 114.034 -172.704 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 56.7 mt -90.29 -42.62 14.22 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.068 0 C-N-CA 123.954 0.902 . . . . 0.0 111.629 178.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 77.7 m -95.24 -53.37 3.81 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 123.114 0.566 . . . . 0.0 110.852 -171.645 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 20.4 t80 80.02 -41.57 0.22 Allowed 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 126.458 1.903 . . . . 0.0 112.617 175.192 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -70.03 -15.1 62.96 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.674 0.79 . . . . 0.0 112.128 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 33.7 m170 -132.1 153.38 81.32 Favored Pre-proline 0 CA--C 1.551 1.017 0 C-N-CA 124.402 1.081 . . . . 0.0 108.588 178.177 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.621 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 60.9 Cg_endo -78.82 -166.23 0.39 Allowed 'Trans proline' 0 C--N 1.379 2.141 0 C-N-CA 123.124 2.549 . . . . 0.0 113.67 -175.238 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.415 HD13 ' HB2' ' A' ' 29' ' ' LYS . 91.3 mt -96.9 146.07 7.99 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.696 0 C-N-CA 124.733 1.213 . . . . 0.0 109.313 174.185 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 28.1 t -141.96 -14.7 0.81 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 123.132 0.573 . . . . 0.0 111.805 176.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -130.95 134.21 46.52 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.135 0.574 . . . . 0.0 110.836 -174.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.485 ' HB ' ' HB2' ' A' ' 58' ' ' TRP . 7.3 p -115.85 140.34 38.14 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 124.041 0.937 . . . . 0.0 110.288 176.227 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -84.71 89.6 7.54 Favored 'General case' 0 C--O 1.242 0.66 0 C-N-CA 124.454 1.101 . . . . 0.0 108.471 175.217 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.4 ' HB3' ' HB3' ' A' ' 54' ' ' SER . 35.7 tt0 -82.18 140.77 45.95 Favored Pre-proline 0 CA--C 1.552 1.034 0 C-N-CA 124.325 1.05 . . . . 0.0 109.988 -177.058 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 14.9 Cg_endo -97.95 31.15 12.26 Favored 'Cis proline' 0 C--N 1.384 2.4 0 CA-C-N 120.226 1.116 . . . . 0.0 114.195 1.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 43.5 t -75.02 -40.91 60.26 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -177.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 85.52 23.64 46.31 Favored Glycine 0 C--N 1.345 1.045 0 C-N-CA 121.619 -0.324 . . . . 0.0 113.655 -176.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.502 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 24.8 m170 -104.59 147.84 27.18 Favored 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 166.812 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.432 ' HG3' HG23 ' A' ' 22' ' ' VAL . 6.3 mptt -132.41 169.47 16.48 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-O 121.602 0.715 . . . . 0.0 112.126 -171.039 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 84.3 p -169.19 -166.43 0.62 Allowed 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.664 1.586 . . . . 0.0 107.594 170.225 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 19.0 p -89.37 154.42 20.08 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 168.248 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.9 -33.99 72.6 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.415 0.686 . . . . 0.0 110.859 -176.551 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -54.88 -40.54 69.85 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.9 0.88 . . . . 0.0 112.52 177.519 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 9.0 m -62.01 -54.56 39.91 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.553 0.741 . . . . 0.0 111.21 178.577 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.411 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 9.5 tp -69.53 -32.55 53.28 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 O-C-N 123.055 0.222 . . . . 0.0 110.739 -175.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 4.6 t30 -58.77 -48.03 82.66 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.643 0.777 . . . . 0.0 110.626 176.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -62.46 -42.18 99.3 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 114.866 -1.061 . . . . 0.0 111.014 176.117 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 52.2 t60 -63.49 -38.52 91.45 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.695 0.798 . . . . 0.0 111.049 -178.749 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.411 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 96.1 mt -69.81 -11.29 60.74 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.809 0.844 . . . . 0.0 112.051 -177.116 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 45.6 mtm -76.48 -15.22 59.95 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 122.821 0.448 . . . . 0.0 111.059 172.545 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 19.3 m-80 -121.09 -64.91 1.19 Allowed 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 124.463 1.105 . . . . 0.0 110.376 -173.726 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 31.1 m-80 -126.81 -174.42 3.13 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 124.842 1.257 . . . . 0.0 109.468 -177.376 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp -137.18 68.89 1.41 Allowed 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 178.063 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.1 m-20 -139.21 165.79 26.24 Favored 'General case' 0 N--CA 1.494 1.726 0 CA-C-O 121.908 0.861 . . . . 0.0 112.076 -168.616 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.502 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 43.7 t -89.67 24.32 2.37 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 125.154 1.382 . . . . 0.0 112.239 -172.03 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 58.93 -86.0 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 125.158 1.383 . . . . 0.0 112.495 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -67.64 -40.39 84.59 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 125.407 1.483 . . . . 0.0 111.382 -162.239 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 7.5 p -108.74 -2.48 18.56 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.181 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 64.5 tttp 66.97 -2.27 1.19 Allowed 'General case' 0 CA--C 1.565 1.526 0 N-CA-C 114.657 1.355 . . . . 0.0 114.657 174.054 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 24.2 m -55.77 124.29 17.02 Favored 'General case' 0 N--CA 1.489 1.523 0 CA-C-N 119.16 0.891 . . . . 0.0 111.112 178.671 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 89.2 m -57.28 134.54 56.05 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.289 0.635 . . . . 0.0 111.674 -178.549 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 48.8 mm -62.38 118.67 4.95 Favored 'Isoleucine or valine' 0 C--N 1.354 0.768 0 C-N-CA 123.511 0.724 . . . . 0.0 110.732 -176.241 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 59.9 t -90.92 -40.33 12.54 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 172.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.4 ' HB3' ' HB3' ' A' ' 24' ' ' GLN . 24.9 t -154.35 146.79 23.98 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.49 0.716 . . . . 0.0 110.148 179.061 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 66.0 t -112.66 103.19 15.05 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 168.59 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -97.25 156.36 16.46 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.528 0.731 . . . . 0.0 109.114 178.046 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -75.65 107.7 7.98 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 170.007 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.485 ' HB2' ' HB ' ' A' ' 22' ' ' VAL . 39.3 t90 -75.73 103.66 5.93 Favored 'General case' 0 C--O 1.241 0.651 0 O-C-N 123.237 0.336 . . . . 0.0 110.21 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -76.71 133.6 39.46 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 170.292 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -70.5 -22.9 62.59 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.816 0.846 . . . . 0.0 111.884 -176.042 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.969 0 N-CA-C 110.4 -1.08 . . . . 0.0 110.4 -175.411 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 35.4 p . . . . . 0 N--CA 1.478 0.95 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 44.9 t-80 66.67 117.45 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 125.715 1.606 . . . . 0.0 110.673 -179.101 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 11.8 tpt 58.25 64.92 3.42 Favored Pre-proline 0 CA--C 1.561 1.394 0 C-N-CA 124.595 1.158 . . . . 0.0 109.463 -170.544 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_exo -75.34 82.81 1.98 Allowed 'Trans proline' 0 C--N 1.385 2.497 0 C-N-CA 123.079 2.52 . . . . 0.0 111.509 -178.178 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 35.0 p -86.65 61.86 7.07 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 124.395 1.078 . . . . 0.0 110.574 179.496 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 46.1 m -126.49 118.83 25.73 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.279 1.031 . . . . 0.0 108.876 -178.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -100.59 109.37 21.45 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.283 0.633 . . . . 0.0 110.335 178.604 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.544 ' HG2' ' H ' ' A' ' 9' ' ' ASP . 32.8 tt0 -160.02 -179.8 8.09 Favored 'General case' 0 CA--C 1.56 1.333 0 C-N-CA 124.825 1.25 . . . . 0.0 107.938 179.053 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.544 ' H ' ' HG2' ' A' ' 8' ' ' GLU . 12.6 t70 -79.29 68.19 5.22 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-O 122.595 1.188 . . . . 0.0 108.524 170.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.612 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 92.8 mt -83.43 160.6 21.54 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 114.119 -1.4 . . . . 0.0 111.256 -176.721 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 42.5 t -61.61 119.26 45.66 Favored Pre-proline 0 N--CA 1.475 0.794 0 CA-C-O 118.744 -0.646 . . . . 0.0 110.37 178.223 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -67.0 -11.49 32.46 Favored 'Trans proline' 0 C--N 1.376 2.023 0 C-N-CA 122.746 2.297 . . . . 0.0 113.208 -177.748 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 68.4 mt -97.73 -28.41 3.69 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.153 0 C-N-CA 124.52 1.128 . . . . 0.0 111.886 -176.127 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 71.1 m -115.81 -38.87 3.59 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 122.841 0.456 . . . . 0.0 110.807 -173.188 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 11.0 t80 79.98 -54.77 0.38 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 126.703 2.001 . . . . 0.0 111.802 175.166 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.5 -38.95 85.99 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 124.084 0.953 . . . . 0.0 112.797 -175.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 65.2 m170 -103.88 153.93 38.42 Favored Pre-proline 0 N--CA 1.486 1.371 0 C-N-CA 123.712 0.805 . . . . 0.0 110.445 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.612 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 97.9 Cg_endo -75.27 -167.83 0.47 Allowed 'Trans proline' 0 C--N 1.38 2.221 0 C-N-CA 123.077 2.518 . . . . 0.0 113.597 -177.361 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.538 HG21 ' HB3' ' A' ' 29' ' ' LYS . 38.8 mt -96.94 147.29 6.41 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 C-N-CA 124.005 0.922 . . . . 0.0 109.938 174.676 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 34.3 p -154.87 25.12 0.44 Allowed 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.995 0.918 . . . . 0.0 110.542 179.141 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -152.56 141.81 21.47 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 124.167 0.987 . . . . 0.0 110.031 178.051 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 6.4 p -137.18 118.99 18.78 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 C-N-CA 124.236 1.014 . . . . 0.0 108.442 176.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -85.02 92.95 8.47 Favored 'General case' 0 C--O 1.244 0.812 0 N-CA-C 108.423 -0.955 . . . . 0.0 108.423 -174.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -83.42 152.62 64.49 Favored Pre-proline 0 CA--C 1.545 0.753 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.498 -178.167 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -89.78 18.12 39.52 Favored 'Cis proline' 0 C--N 1.38 2.223 0 N-CA-C 114.297 0.845 . . . . 0.0 114.297 0.413 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 36.6 t -65.4 -64.59 0.83 Allowed 'General case' 0 C--N 1.356 0.871 0 C-N-CA 123.064 0.545 . . . . 0.0 111.84 -176.549 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 125.67 -19.73 6.58 Favored Glycine 0 C--N 1.345 1.062 0 CA-C-O 118.951 -0.916 . . . . 0.0 113.465 -176.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.455 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 9.4 m170 -61.01 144.41 53.45 Favored 'General case' 0 N--CA 1.487 1.409 0 CA-C-N 117.733 0.766 . . . . 0.0 110.494 176.728 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.538 ' HB3' HG21 ' A' ' 19' ' ' ILE . 58.3 mttp -136.48 157.45 46.75 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 123.876 0.87 . . . . 0.0 110.798 -170.534 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 94.6 p -169.04 179.55 4.0 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.86 1.264 . . . . 0.0 108.556 171.739 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 14.4 p -68.12 142.17 55.86 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 171.343 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.99 -21.65 66.29 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -175.104 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -58.63 -38.47 78.14 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.881 0.873 . . . . 0.0 111.329 173.247 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.8 m -58.59 -55.63 32.53 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 124.07 0.948 . . . . 0.0 111.592 177.359 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.53 HG12 HG21 ' A' ' 55' ' ' VAL . 9.2 tp -73.6 -33.86 40.19 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 O-C-N 123.422 0.451 . . . . 0.0 111.19 -173.269 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -62.96 -41.03 99.41 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-O 120.944 0.402 . . . . 0.0 110.429 175.79 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -74.88 -28.67 60.74 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 123.685 0.794 . . . . 0.0 110.915 176.707 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 83.2 t60 -69.79 -45.81 67.15 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.841 0.856 . . . . 0.0 110.417 -178.259 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 97.4 mt -60.82 -19.08 59.06 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 124.083 0.953 . . . . 0.0 112.656 -176.356 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 84.4 mmm -61.56 -32.59 72.67 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.37 1.068 . . . . 0.0 112.002 173.651 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 77.3 m-20 -116.4 -58.24 2.11 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.34 0.656 . . . . 0.0 111.134 -176.787 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -122.71 160.66 25.41 Favored 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 124.144 0.977 . . . . 0.0 110.947 -176.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 47.6 mtpt -126.46 63.66 1.27 Allowed 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 174.844 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -128.59 158.12 39.37 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 115.136 -0.938 . . . . 0.0 109.944 -174.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.455 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 42.3 t -87.7 37.37 0.79 Allowed 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 123.675 0.79 . . . . 0.0 111.875 -176.396 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 57.6 -85.3 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 125.697 1.599 . . . . 0.0 112.775 173.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 -74.82 -39.07 61.86 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.639 1.176 . . . . 0.0 111.758 -165.217 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 14.2 p -107.05 -2.53 20.97 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 122.952 0.501 . . . . 0.0 110.994 -179.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 83.8 tttt 66.39 -4.18 0.74 Allowed 'General case' 0 CA--C 1.566 1.582 0 C-N-CA 125.492 1.517 . . . . 0.0 114.917 176.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 22.9 m -51.11 121.16 5.7 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 119.27 0.941 . . . . 0.0 111.128 -177.299 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 20.6 m -51.6 127.84 21.49 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.393 0.677 . . . . 0.0 110.772 -177.077 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.454 HG13 HD11 ' A' ' 35' ' ' ILE . 42.4 mm -60.71 103.28 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.353 0.724 0 O-C-N 123.756 0.66 . . . . 0.0 110.64 -175.542 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 47.4 t -75.76 -55.4 11.5 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 CA-C-N 115.047 -0.979 . . . . 0.0 108.44 174.207 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.8 t -153.57 153.06 31.66 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 123.128 0.571 . . . . 0.0 110.582 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.53 HG21 HG12 ' A' ' 35' ' ' ILE . 58.1 t -127.53 127.13 68.43 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 124.532 1.133 . . . . 0.0 108.462 175.428 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -108.64 143.72 37.34 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.599 0.76 . . . . 0.0 109.055 173.128 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -66.13 106.21 1.58 Allowed 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 108.428 -0.952 . . . . 0.0 108.428 174.313 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 72.1 t90 -69.46 95.55 0.83 Allowed 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 177.209 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -91.46 115.74 28.28 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 114.803 -1.089 . . . . 0.0 109.434 -178.799 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -71.27 146.29 49.04 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 122.754 0.421 . . . . 0.0 110.815 -179.753 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 1.426 0 CA-C-O 118.867 -0.963 . . . . 0.0 113.027 -177.155 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 23.2 t . . . . . 0 N--CA 1.475 0.796 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 49.2 m80 -58.91 117.9 5.16 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.292 0.637 . . . . 0.0 110.83 178.17 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 54.1 ttm -164.43 81.94 1.3 Allowed Pre-proline 0 CA--C 1.551 0.989 0 C-N-CA 124.355 1.062 . . . . 0.0 108.566 177.099 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -86.91 -166.96 0.33 Allowed 'Trans proline' 0 C--N 1.375 1.926 0 C-N-CA 123.037 2.491 . . . . 0.0 111.729 178.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 7.0 m 70.99 -5.88 1.41 Allowed 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 124.41 1.084 . . . . 0.0 112.748 173.21 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 21.1 m -80.85 83.78 6.51 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.961 0.904 . . . . 0.0 110.283 -172.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -126.76 100.34 6.15 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.58 0.752 . . . . 0.0 110.069 -178.454 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -163.31 -169.03 1.86 Allowed 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.773 1.229 . . . . 0.0 109.489 179.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -79.43 62.48 3.77 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 168.627 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.739 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 94.6 mt -83.76 153.81 23.92 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-N 114.828 -1.078 . . . . 0.0 111.777 -173.394 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.42 ' SG ' ' HB ' ' A' ' 13' ' ' ILE . 51.0 t -67.15 114.34 17.97 Favored Pre-proline 0 CA--C 1.545 0.759 0 CA-C-N 114.413 -1.267 . . . . 0.0 109.223 171.583 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -64.0 -8.28 15.66 Favored 'Trans proline' 0 C--N 1.374 1.897 0 C-N-CA 122.814 2.343 . . . . 0.0 113.353 -179.324 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.42 ' HB ' ' SG ' ' A' ' 11' ' ' CYS . 3.6 mp -84.52 -44.98 17.9 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.989 0 C-N-CA 124.186 0.994 . . . . 0.0 110.172 175.258 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 78.8 m -107.39 -46.87 3.76 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.348 0.659 . . . . 0.0 112.688 -165.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 97.6 m-85 76.81 -39.17 0.33 Allowed 'General case' 0 N--CA 1.499 2.012 0 C-N-CA 126.196 1.798 . . . . 0.0 113.419 178.337 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.75 -20.58 65.25 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.371 0.668 . . . . 0.0 112.797 -177.293 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 80.3 m-70 -134.72 152.74 78.14 Favored Pre-proline 0 C--O 1.248 0.977 0 C-N-CA 123.728 0.811 . . . . 0.0 109.371 -179.14 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.739 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 83.0 Cg_endo -72.66 -166.07 0.26 Allowed 'Trans proline' 0 C--N 1.38 2.224 0 C-N-CA 122.925 2.417 . . . . 0.0 113.822 -178.291 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.604 HG21 ' HB3' ' A' ' 29' ' ' LYS . 92.4 mt -94.64 146.0 7.33 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 C-N-CA 124.469 1.108 . . . . 0.0 108.63 172.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 18.9 t -147.33 9.36 0.95 Allowed 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.172 0.589 . . . . 0.0 110.922 178.26 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.412 ' HA ' ' HA ' ' A' ' 57' ' ' ASP . . . -142.29 141.96 32.48 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.173 0.589 . . . . 0.0 110.677 -179.014 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.1 p -119.35 136.99 54.73 Favored 'Isoleucine or valine' 0 C--O 1.245 0.83 0 C-N-CA 124.08 0.952 . . . . 0.0 109.491 177.763 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.408 ' HB3' HG12 ' A' ' 52' ' ' ILE . 10.3 m-30 -98.63 87.44 3.8 Favored 'General case' 0 C--O 1.241 0.644 0 C-N-CA 123.877 0.871 . . . . 0.0 109.057 -177.134 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 17.0 mt-30 -81.9 147.6 58.73 Favored Pre-proline 0 CA--C 1.546 0.803 0 CA-C-N 115.217 -0.901 . . . . 0.0 111.383 -176.403 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.497 ' HD3' ' HB ' ' A' ' 53' ' ' VAL . 43.6 Cg_endo -97.44 24.36 22.42 Favored 'Cis proline' 0 C--N 1.374 1.871 0 C-N-CA 125.322 -0.699 . . . . 0.0 113.384 -0.267 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 37.5 t -71.53 -49.37 41.49 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 122.696 0.398 . . . . 0.0 110.759 -179.102 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 108.79 -12.66 35.12 Favored Glycine 0 C--N 1.348 1.229 0 CA-C-O 119.429 -0.651 . . . . 0.0 114.032 179.119 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.414 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 11.1 m80 -64.53 143.51 57.86 Favored 'General case' 0 N--CA 1.484 1.269 0 CA-C-N 117.391 0.596 . . . . 0.0 110.351 173.487 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.604 ' HB3' HG21 ' A' ' 19' ' ' ILE . 96.2 mttt -135.54 149.6 49.51 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.632 0.773 . . . . 0.0 110.844 -168.831 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 47.2 t -157.64 173.75 16.38 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.253 1.021 . . . . 0.0 109.069 178.785 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 12.3 p -68.0 146.87 53.13 Favored 'General case' 0 C--O 1.243 0.757 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 176.161 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt -61.78 -28.25 69.32 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.456 0.702 . . . . 0.0 111.777 -174.479 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -62.68 -42.18 99.49 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.765 0.826 . . . . 0.0 111.933 178.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.1 m -56.09 -56.21 23.65 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.315 0.646 . . . . 0.0 111.271 178.408 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.443 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 7.7 tp -73.67 -34.37 41.08 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.75 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.285 -173.767 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -56.85 -46.76 81.56 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 123.294 0.637 . . . . 0.0 110.429 177.054 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -66.41 -40.64 89.71 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.68 176.271 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 82.5 t60 -74.16 -24.28 59.37 Favored 'General case' 0 C--O 1.215 -0.754 0 CA-C-N 115.272 -0.877 . . . . 0.0 112.722 -172.414 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.443 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 73.2 mt -61.95 -22.41 65.6 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 122.985 0.514 . . . . 0.0 111.976 -179.143 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 24.6 mmt -75.34 -31.14 60.47 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 123.697 0.799 . . . . 0.0 110.643 174.241 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 23.6 m-20 -84.18 -76.33 0.3 Allowed 'General case' 0 CA--C 1.553 1.058 0 C-N-CA 123.937 0.895 . . . . 0.0 109.251 177.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -141.45 -167.23 2.37 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 125.198 1.399 . . . . 0.0 109.641 -176.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -141.98 87.72 2.06 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 173.516 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -152.17 162.42 41.15 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.062 179.564 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.414 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 79.3 m -62.18 142.33 57.7 Favored 'General case' 0 C--N 1.347 0.465 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.206 173.605 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 71.1 m-85 -82.86 26.34 0.6 Allowed 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.379 0.672 . . . . 0.0 110.271 172.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 48.4 m-85 -139.38 -77.2 0.34 Allowed 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 124.21 1.004 . . . . 0.0 108.93 -169.11 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 1.8 p -95.07 -1.86 51.28 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.178 0.591 . . . . 0.0 111.394 -177.388 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 8.6 mtmp? 63.78 9.54 4.5 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 125.04 1.336 . . . . 0.0 113.928 176.598 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 87.4 m -65.6 128.84 37.57 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.236 0.614 . . . . 0.0 111.116 177.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 56.9 m -58.16 133.64 55.79 Favored 'General case' 0 C--N 1.352 0.695 0 O-C-N 124.456 1.098 . . . . 0.0 111.512 178.306 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.451 HG21 HG22 ' A' ' 55' ' ' VAL . 30.8 mt -86.6 119.9 35.33 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 C-N-CA 123.907 0.883 . . . . 0.0 109.716 -177.621 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.497 ' HB ' ' HD3' ' A' ' 25' ' ' PRO . 61.1 t -78.91 -35.46 17.86 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.922 0 C-N-CA 123.096 0.558 . . . . 0.0 109.96 178.85 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.7 t -145.91 131.7 19.03 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 122.941 0.496 . . . . 0.0 110.331 175.46 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.451 HG22 HG21 ' A' ' 52' ' ' ILE . 56.6 t -100.48 111.89 31.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 175.771 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -117.71 -178.52 3.5 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 123.095 0.558 . . . . 0.0 110.179 174.544 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.412 ' HA ' ' HA ' ' A' ' 21' ' ' ALA . 35.9 m-20 -100.05 164.37 12.02 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.589 0.756 . . . . 0.0 109.947 178.446 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 54.7 t90 -139.83 111.75 7.45 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 179.594 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -80.41 151.15 29.5 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.163 0.585 . . . . 0.0 110.26 177.592 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -155.66 129.74 8.74 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 177.812 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.095 0 N-CA-C 111.053 -0.819 . . . . 0.0 111.053 178.891 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 25.9 p . . . . . 0 N--CA 1.469 0.507 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 79.0 m80 -135.05 179.97 5.99 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.234 1.013 . . . . 0.0 110.13 -178.329 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.409 ' SD ' ' N ' ' A' ' 3' ' ' MET . 1.0 OUTLIER -96.94 93.71 1.52 Allowed Pre-proline 0 CA--C 1.548 0.879 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 168.594 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -86.99 11.4 3.27 Favored 'Trans proline' 0 C--N 1.375 1.957 0 C-N-CA 122.848 2.365 . . . . 0.0 113.615 -170.508 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 87.6 m -145.67 -82.53 0.14 Allowed 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 123.631 0.772 . . . . 0.0 109.604 178.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 74.3 m -164.4 171.58 14.54 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 124.468 1.107 . . . . 0.0 109.715 -176.533 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 64.45 -178.08 0.17 Allowed 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 124.823 1.249 . . . . 0.0 113.868 168.014 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -116.59 -163.31 0.9 Allowed 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 114.268 -1.333 . . . . 0.0 109.059 175.521 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 57.85 26.8 13.69 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 123.934 0.894 . . . . 0.0 111.123 -177.246 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.567 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 59.6 mt -65.34 129.1 38.53 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 123.514 0.725 . . . . 0.0 110.577 -174.78 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 46.1 t -50.19 114.78 4.69 Favored Pre-proline 0 CA--C 1.546 0.825 0 O-C-N 124.387 1.054 . . . . 0.0 109.869 179.445 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_exo -57.55 -14.33 16.45 Favored 'Trans proline' 0 C--N 1.38 2.236 0 C-N-CA 123.352 2.701 . . . . 0.0 114.358 -172.778 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.6 mp -89.51 -42.47 14.4 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.253 0 C-N-CA 124.272 1.029 . . . . 0.0 110.047 177.507 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 79.8 m -102.12 -55.03 2.57 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.599 0.76 . . . . 0.0 112.688 -169.04 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.502 ' HA ' ' HB3' ' A' ' 10' ' ' LEU . 96.0 m-85 77.09 -32.29 0.18 Allowed 'General case' 0 N--CA 1.495 1.804 0 C-N-CA 126.318 1.847 . . . . 0.0 113.345 -178.528 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.5 -36.91 79.48 Favored 'General case' 0 N--CA 1.484 1.25 0 CA-C-N 118.564 0.62 . . . . 0.0 111.917 -179.152 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 10.9 m170 -127.07 155.14 76.42 Favored Pre-proline 0 N--CA 1.482 1.145 0 C-N-CA 124.441 1.097 . . . . 0.0 109.139 178.77 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.567 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 92.6 Cg_endo -76.91 -159.6 0.1 Allowed 'Trans proline' 0 C--N 1.376 2.023 0 C-N-CA 122.707 2.272 . . . . 0.0 113.936 179.379 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.442 HG21 ' HB3' ' A' ' 29' ' ' LYS . 83.0 mt -78.58 138.0 20.95 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.799 0 C-N-CA 124.285 1.034 . . . . 0.0 110.906 177.504 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.2 m -110.8 -27.77 8.71 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.568 0.747 . . . . 0.0 110.731 176.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.457 ' HB1' HG12 ' A' ' 55' ' ' VAL . . . -147.58 154.16 40.34 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.096 0.558 . . . . 0.0 111.778 -166.097 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 5.7 p -123.46 124.81 70.51 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.95 0 C-N-CA 124.552 1.141 . . . . 0.0 109.851 179.311 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -77.41 94.7 4.28 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.12 0.968 . . . . 0.0 108.97 178.55 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 -98.09 155.46 36.98 Favored Pre-proline 0 CA--C 1.546 0.823 0 C-N-CA 123.054 0.542 . . . . 0.0 111.14 -174.603 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -85.72 18.89 27.95 Favored 'Cis proline' 0 C--N 1.383 2.378 0 N-CA-C 115.049 1.134 . . . . 0.0 115.049 3.342 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 53.4 t -67.8 -65.07 0.74 Allowed 'General case' 0 C--N 1.354 0.765 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -177.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 124.93 -16.87 7.25 Favored Glycine 0 C--N 1.35 1.313 0 CA-C-O 119.13 -0.817 . . . . 0.0 114.211 179.5 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.569 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 21.5 m80 -63.94 149.14 47.89 Favored 'General case' 0 N--CA 1.482 1.146 0 CA-C-N 117.644 0.722 . . . . 0.0 110.206 171.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.442 ' HB3' HG21 ' A' ' 19' ' ' ILE . 83.1 mttt -137.22 161.58 35.82 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 123.703 0.801 . . . . 0.0 110.77 -168.324 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 38.3 t -172.98 178.65 2.48 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.847 1.259 . . . . 0.0 108.714 178.344 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 13.6 p -79.36 153.11 30.01 Favored 'General case' 0 C--O 1.246 0.9 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 173.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt -67.19 -23.6 65.77 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.289 0.636 . . . . 0.0 111.767 -173.353 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.51 -42.29 92.22 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.744 0.818 . . . . 0.0 111.553 177.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 8.7 m -56.78 -54.5 45.63 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.447 0.699 . . . . 0.0 110.851 176.429 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.531 HG12 HG21 ' A' ' 55' ' ' VAL . 9.8 tp -74.97 -23.36 17.39 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.982 0 O-C-N 123.688 0.617 . . . . 0.0 111.11 -174.67 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -62.56 -55.41 27.49 Favored 'General case' 0 N--CA 1.487 1.414 0 CA-C-O 121.505 0.669 . . . . 0.0 109.868 173.831 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 61.0 tt0 -70.44 -19.55 62.96 Favored 'General case' 0 CA--C 1.553 1.06 0 CA-C-N 114.519 -1.219 . . . . 0.0 111.063 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 62.7 t60 -81.51 -41.74 21.25 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.347 0.659 . . . . 0.0 111.367 178.685 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 48.9 mt -66.85 -24.49 66.15 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.122 0.569 . . . . 0.0 112.527 -173.445 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 27.3 ptm -69.99 -21.21 63.25 Favored 'General case' 0 N--CA 1.482 1.174 0 CA-C-O 120.576 0.226 . . . . 0.0 110.957 175.315 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 66.0 m-20 -106.02 -73.86 0.67 Allowed 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.882 0.873 . . . . 0.0 109.749 -179.041 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -111.68 -174.57 2.49 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 124.545 1.138 . . . . 0.0 110.491 -176.736 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 22.1 ttmm -139.82 15.64 2.49 Favored 'General case' 0 N--CA 1.486 1.33 0 CA-C-O 121.484 0.659 . . . . 0.0 110.665 179.63 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -88.86 164.17 15.31 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-O 121.326 0.584 . . . . 0.0 111.408 -174.469 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.569 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 43.5 t -91.66 32.87 1.05 Allowed 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 124.526 1.13 . . . . 0.0 112.664 -172.427 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 57.7 -83.46 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 125.231 1.413 . . . . 0.0 112.646 174.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -67.55 -24.96 65.59 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 125.505 1.522 . . . . 0.0 112.735 -167.022 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 15.2 p -131.03 -7.48 3.9 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 122.93 0.492 . . . . 0.0 111.195 -176.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 55.2 tttm 64.48 11.91 6.96 Favored 'General case' 0 CA--C 1.569 1.691 0 C-N-CA 124.784 1.234 . . . . 0.0 113.548 177.002 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 26.7 m -62.86 133.7 55.1 Favored 'General case' 0 N--CA 1.481 1.088 0 O-C-N 121.407 -0.808 . . . . 0.0 110.451 176.412 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 23.8 m -60.79 119.84 8.96 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.112 0.565 . . . . 0.0 110.323 179.385 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.483 HG21 HG22 ' A' ' 55' ' ' VAL . 46.6 mt -79.54 122.2 34.29 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 O-C-N 123.454 0.471 . . . . 0.0 109.754 -179.68 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 46.2 t -81.53 -38.53 16.3 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 C-N-CA 123.208 0.603 . . . . 0.0 109.553 175.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 34.2 p -168.11 136.97 2.41 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.706 0.803 . . . . 0.0 110.713 175.615 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.531 HG21 HG12 ' A' ' 35' ' ' ILE . 21.7 t -96.72 113.56 31.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 123.87 0.868 . . . . 0.0 109.254 178.064 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.1 mm-40 -85.24 172.86 10.82 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 110.073 -0.343 . . . . 0.0 110.073 175.313 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -87.52 135.56 33.3 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 174.212 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 73.4 t90 -117.78 120.84 39.15 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 175.698 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -138.57 141.75 39.24 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.416 1.086 . . . . 0.0 109.431 178.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 59.5 mtmt -80.6 79.37 7.23 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-O 121.501 0.667 . . . . 0.0 109.402 172.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.664 -1.075 . . . . 0.0 110.88 -176.671 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 46.3 t . . . . . 0 N--CA 1.482 1.172 0 CA-C-O 120.961 0.41 . . . . 0.0 110.212 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 50.9 m-70 -103.8 -10.54 18.18 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.283 1.033 . . . . 0.0 110.265 178.713 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 22.2 ttt -104.74 104.93 48.54 Favored Pre-proline 0 CA--C 1.556 1.204 0 C-N-CA 124.162 0.985 . . . . 0.0 108.945 -178.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -85.23 59.56 5.3 Favored 'Trans proline' 0 C--N 1.378 2.119 0 C-N-CA 123.317 2.678 . . . . 0.0 112.896 -176.137 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 13.7 m -64.89 114.44 4.52 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.088 0.955 . . . . 0.0 111.645 -174.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.3 t -152.34 92.55 1.7 Allowed 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.303 0.641 . . . . 0.0 109.564 -178.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.416 ' HG3' HD12 ' A' ' 10' ' ' LEU . 3.6 mp0 -75.43 133.95 41.01 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.993 176.334 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -112.97 38.12 2.92 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 108.328 -0.989 . . . . 0.0 108.328 168.497 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.472 ' HB3' HD12 ' A' ' 19' ' ' ILE . 13.9 m-20 75.17 77.37 0.1 Allowed 'General case' 0 C--N 1.359 1.016 0 C-N-CA 126.476 1.911 . . . . 0.0 109.525 -167.697 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.611 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 93.3 mt -93.5 157.89 15.98 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 114.65 -1.159 . . . . 0.0 110.617 178.766 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.463 ' HB3' ' HB2' ' A' ' 14' ' ' CYS . 42.4 t -66.74 116.42 34.77 Favored Pre-proline 0 CA--C 1.552 1.041 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 175.468 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_endo -58.23 -17.28 31.78 Favored 'Trans proline' 0 C--N 1.382 2.321 0 C-N-CA 123.417 2.745 . . . . 0.0 114.119 -174.683 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 73.3 mt -88.17 -45.88 15.81 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.885 0 C-N-CA 123.882 0.873 . . . . 0.0 110.788 176.544 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.463 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . 86.3 m -90.76 -55.58 3.51 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.126 0.57 . . . . 0.0 111.73 -167.861 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 84.3 m-85 74.84 -43.32 0.52 Allowed 'General case' 0 N--CA 1.494 1.743 0 C-N-CA 126.285 1.834 . . . . 0.0 111.872 -174.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.3 -30.6 71.26 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 124.004 0.921 . . . . 0.0 112.372 -178.752 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 21.7 m-70 -124.4 151.23 66.35 Favored Pre-proline 0 N--CA 1.479 1.016 0 C-N-CA 124.047 0.939 . . . . 0.0 109.521 176.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.611 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 13.1 Cg_exo -71.36 -164.55 0.16 Allowed 'Trans proline' 0 C--N 1.381 2.259 0 C-N-CA 123.898 3.066 . . . . 0.0 114.086 -177.075 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.472 HD12 ' HB3' ' A' ' 9' ' ' ASP . 83.2 mt -86.51 129.93 37.52 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.84 0 C-N-CA 123.466 0.706 . . . . 0.0 110.065 175.726 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 25.8 t -132.46 6.44 4.11 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 123.876 0.87 . . . . 0.0 110.875 178.733 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -154.95 160.93 41.48 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-O 121.343 0.592 . . . . 0.0 111.413 -178.279 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 4.7 p -145.71 139.76 21.52 Favored 'Isoleucine or valine' 0 C--O 1.244 0.781 0 C-N-CA 124.863 1.265 . . . . 0.0 108.752 177.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -96.79 88.11 4.5 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 178.125 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 16.1 mt-30 -84.95 149.41 53.24 Favored Pre-proline 0 C--O 1.242 0.704 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.359 -176.407 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -92.29 22.38 29.34 Favored 'Cis proline' 0 C--N 1.383 2.368 0 N-CA-C 114.776 1.029 . . . . 0.0 114.776 2.209 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 35.3 t -69.13 -50.12 50.85 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 122.767 0.427 . . . . 0.0 111.555 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 105.58 -6.08 41.23 Favored Glycine 0 C--N 1.343 0.96 0 CA-C-O 118.967 -0.907 . . . . 0.0 114.619 177.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.437 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 3.8 m170 -62.99 128.14 34.47 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 117.662 0.731 . . . . 0.0 110.016 173.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -101.21 156.82 17.21 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.219 1.008 . . . . 0.0 110.897 -174.049 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 79.9 p -168.72 -157.34 0.19 Allowed 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.415 1.086 . . . . 0.0 108.257 175.176 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 30.8 p -116.44 161.19 19.46 Favored 'General case' 0 C--O 1.247 0.964 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 170.179 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 57.5 mtpt -57.07 -40.17 76.39 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 123.494 0.718 . . . . 0.0 111.12 -179.295 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -53.83 -42.13 68.12 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 123.918 0.887 . . . . 0.0 113.086 179.197 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 8.7 m -60.32 -56.63 19.1 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.653 0.781 . . . . 0.0 111.274 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.422 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 8.6 tp -72.92 -35.36 48.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.519 -171.901 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -61.29 -47.45 85.91 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.207 0.603 . . . . 0.0 111.279 177.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 37.0 tt0 -62.94 -34.38 77.35 Favored 'General case' 0 CA--C 1.554 1.102 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.657 176.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 84.8 t60 -73.56 -37.51 65.52 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.274 1.03 . . . . 0.0 112.477 -178.334 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 77.8 mt -64.6 -17.56 64.11 Favored 'General case' 0 N--CA 1.492 1.644 0 C-N-CA 123.505 0.722 . . . . 0.0 112.569 -174.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 87.1 mtp -66.86 -29.16 68.99 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.297 0.639 . . . . 0.0 111.021 174.271 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 31.5 t30 -105.15 -72.89 0.69 Allowed 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 123.91 0.884 . . . . 0.0 110.269 177.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 79.3 m-20 -115.98 164.61 14.17 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.45 0.7 . . . . 0.0 110.783 -173.873 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -124.51 45.65 2.47 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.065 0.946 . . . . 0.0 108.93 176.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -109.18 168.65 9.22 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.498 177.547 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.437 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 41.6 t -93.61 32.5 1.39 Allowed 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 124.668 1.187 . . . . 0.0 111.922 -171.414 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 59.4 -84.35 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 125.616 1.566 . . . . 0.0 112.287 175.817 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 16.4 m-85 -70.6 -32.98 70.54 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.879 1.272 . . . . 0.0 112.05 -164.606 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 14.8 p -119.53 -6.2 10.24 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 122.926 0.49 . . . . 0.0 111.161 -178.109 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 55.4 mtpt 60.28 18.69 8.21 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 114.82 1.415 . . . . 0.0 114.82 178.559 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 45.6 m -62.9 137.1 58.18 Favored 'General case' 0 N--CA 1.48 1.053 0 CA-C-N 118.173 0.442 . . . . 0.0 109.936 174.081 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 29.0 m -58.15 129.64 42.93 Favored 'General case' 0 C--O 1.246 0.9 0 C-N-CA 123.24 0.616 . . . . 0.0 110.331 177.69 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 41.9 mm -66.64 102.01 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.814 0 O-C-N 123.724 0.64 . . . . 0.0 109.724 179.046 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 97.7 t -73.16 -37.69 53.17 Favored 'Isoleucine or valine' 0 C--O 1.242 0.687 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 172.071 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.8 p -158.57 133.21 8.17 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.455 174.521 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 48.5 t -90.37 116.99 32.75 Favored 'Isoleucine or valine' 0 C--N 1.353 0.73 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 163.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -122.63 135.55 54.64 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 177.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -60.92 159.16 11.81 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.665 0.786 . . . . 0.0 110.201 173.344 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 37.3 t90 -146.63 140.81 26.3 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 -177.138 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -129.15 146.92 50.98 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.849 0.86 . . . . 0.0 110.494 -172.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.458 ' HE2' ' HB2' ' A' ' 9' ' ' ASP . 35.0 mmtp -72.89 -41.26 64.82 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 123.662 0.785 . . . . 0.0 110.13 172.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.326 0 CA-C-O 118.963 -0.909 . . . . 0.0 110.841 -179.939 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 34.9 p . . . . . 0 N--CA 1.471 0.618 0 N-CA-C 110.315 -0.254 . . . . 0.0 110.315 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 9.4 p80 -110.24 166.39 11.0 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 172.197 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 26.7 ttt 61.96 90.48 0.09 OUTLIER Pre-proline 0 CA--C 1.556 1.197 0 C-N-CA 124.44 1.096 . . . . 0.0 111.504 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -80.32 93.51 1.04 Allowed 'Trans proline' 0 C--N 1.368 1.556 0 C-N-CA 122.68 2.254 . . . . 0.0 110.012 174.415 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 74.8 p -66.28 137.08 56.69 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.388 0.675 . . . . 0.0 110.131 -177.305 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 46.7 t -138.96 97.75 3.38 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 123.835 0.854 . . . . 0.0 110.825 -174.094 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -86.11 99.67 11.66 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 107.275 -1.38 . . . . 0.0 107.275 167.414 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -123.65 -178.29 3.99 Favored 'General case' 0 CA--C 1.553 1.088 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.519 -166.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.457 ' O ' HG13 ' A' ' 19' ' ' ILE . 4.9 m-20 -77.83 40.53 0.32 Allowed 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 124.917 1.287 . . . . 0.0 111.592 -177.616 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.511 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 74.4 mt -67.28 135.48 53.42 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.783 0.833 . . . . 0.0 112.106 -167.319 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 52.5 t -57.2 114.93 9.09 Favored Pre-proline 0 CA--C 1.55 0.952 0 O-C-N 124.308 1.005 . . . . 0.0 108.868 174.143 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -57.35 -19.84 37.13 Favored 'Trans proline' 0 N--CA 1.508 2.361 0 C-N-CA 123.373 2.716 . . . . 0.0 114.185 -175.172 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.8 mp -80.02 -26.76 12.04 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.468 0 C-N-CA 124.269 1.028 . . . . 0.0 110.774 -176.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 40.4 m -133.33 -42.06 0.87 Allowed 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 113.256 0.836 . . . . 0.0 113.256 -161.162 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 93.1 m-85 77.94 -37.64 0.24 Allowed 'General case' 0 N--CA 1.496 1.846 0 C-N-CA 126.248 1.819 . . . . 0.0 113.108 178.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -74.59 -6.95 51.44 Favored 'General case' 0 CA--C 1.555 1.156 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 -169.032 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 66.9 m-70 -141.49 137.72 16.74 Favored Pre-proline 0 N--CA 1.494 1.734 0 CA-C-N 118.658 0.663 . . . . 0.0 109.936 174.634 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.511 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 47.2 Cg_endo -88.62 80.69 0.94 Allowed 'Trans proline' 0 C--N 1.383 2.355 0 C-N-CA 123.429 2.753 . . . . 0.0 114.027 -178.725 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.457 HG13 ' O ' ' A' ' 9' ' ' ASP . 64.7 mt 63.07 155.5 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.037 0 C-N-CA 124.948 1.299 . . . . 0.0 111.957 -178.945 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.416 ' HB3' ' H ' ' A' ' 32' ' ' LYS . 26.3 t -159.81 -7.6 0.06 Allowed 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 122.696 0.398 . . . . 0.0 111.766 173.126 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -152.03 132.52 13.83 Favored 'General case' 0 N--CA 1.481 1.083 0 CA-C-N 118.348 0.522 . . . . 0.0 111.144 -175.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.2 p -102.41 132.89 47.53 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.88 0 C-N-CA 124.231 1.013 . . . . 0.0 109.834 173.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -93.71 100.11 12.39 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.118 -178.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 -90.02 151.47 45.14 Favored Pre-proline 0 CA--C 1.545 0.759 0 C-N-CA 123.61 0.764 . . . . 0.0 110.92 178.07 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_endo -92.44 32.21 10.7 Favored 'Cis proline' 0 C--N 1.376 2.011 0 CA-C-N 118.528 0.51 . . . . 0.0 113.112 3.436 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.7 t -83.49 -72.83 0.44 Allowed 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 122.67 0.388 . . . . 0.0 111.246 -179.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 133.67 -30.4 2.99 Favored Glycine 0 C--N 1.349 1.254 0 CA-C-O 119.696 -0.502 . . . . 0.0 112.674 -176.028 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 20.1 m170 -57.29 132.3 52.62 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 123.385 0.674 . . . . 0.0 110.717 175.536 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 50.3 mttp -115.52 150.66 36.2 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.152 0.981 . . . . 0.0 110.44 -175.847 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 54.5 p -142.13 -155.94 0.64 Allowed 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 166.168 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 22.3 p -99.41 162.09 13.24 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 118.312 0.506 . . . . 0.0 109.79 173.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.416 ' H ' ' HB3' ' A' ' 20' ' ' SER . 56.0 mtpt -63.58 -34.6 78.18 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.029 0.932 . . . . 0.0 111.282 -179.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.87 -32.51 70.78 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.42 0.688 . . . . 0.0 111.584 176.761 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.4 m -63.52 -55.39 24.35 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.507 0.723 . . . . 0.0 111.07 176.574 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.663 HG12 HG21 ' A' ' 55' ' ' VAL . 8.8 tp -69.75 -37.74 74.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 O-C-N 123.579 0.549 . . . . 0.0 110.95 -173.491 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -63.47 -38.44 91.15 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-O 121.134 0.492 . . . . 0.0 110.683 178.561 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -73.18 -32.69 64.98 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 123.538 0.735 . . . . 0.0 110.675 175.423 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 59.8 t60 -72.94 -32.5 65.32 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.86 0.864 . . . . 0.0 110.713 -176.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 35' ' ' ILE . 97.4 mt -72.39 -7.42 49.6 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.864 0.866 . . . . 0.0 111.9 -179.072 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 92.9 mmm -74.31 -14.11 60.85 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 123.657 0.783 . . . . 0.0 110.851 168.315 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 19.1 t30 -131.37 -73.17 0.53 Allowed 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 124.131 0.972 . . . . 0.0 111.064 -175.943 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -126.79 -170.07 2.14 Favored 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 123.695 0.798 . . . . 0.0 111.177 -176.152 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -145.34 35.36 1.08 Allowed 'General case' 0 N--CA 1.476 0.825 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 176.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.506 ' HA ' ' HA ' ' A' ' 51' ' ' THR . 4.5 m-20 -99.16 156.82 16.76 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.144 -177.16 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.453 ' HB2' ' O ' ' A' ' 50' ' ' THR . 5.4 t -72.01 115.66 11.5 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 86.9 m-85 -49.42 -34.66 17.02 Favored 'General case' 0 N--CA 1.495 1.823 0 C-N-CA 123.989 0.916 . . . . 0.0 112.866 -177.175 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 77.6 m-85 -91.7 -28.04 17.69 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 115.2 -0.909 . . . . 0.0 112.777 -169.617 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 7.8 p -149.61 22.72 0.9 Allowed 'General case' 0 N--CA 1.496 1.857 0 N-CA-C 113.316 0.858 . . . . 0.0 113.316 -169.155 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 65.7 mttm 71.24 -28.22 0.18 Allowed 'General case' 0 N--CA 1.505 2.277 0 N-CA-C 115.671 1.73 . . . . 0.0 115.671 172.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.453 ' O ' ' HB2' ' A' ' 45' ' ' CYS . 7.7 m -57.43 114.25 2.13 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.75 0.82 . . . . 0.0 112.268 -169.483 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.506 ' HA ' ' HA ' ' A' ' 44' ' ' ASP . 24.8 m -57.48 123.67 16.3 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 123.369 0.668 . . . . 0.0 110.508 -179.63 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.546 HG21 HG22 ' A' ' 55' ' ' VAL . 12.2 mt -71.97 122.57 24.59 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 124.86 1.264 . . . . 0.0 109.515 -175.75 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 83.9 t -81.39 -34.31 13.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 C-N-CA 122.968 0.507 . . . . 0.0 109.842 178.43 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 24.5 t -156.29 135.7 12.28 Favored 'General case' 0 C--N 1.355 0.828 0 CA-C-O 120.935 0.397 . . . . 0.0 110.596 -179.058 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.663 HG21 HG12 ' A' ' 35' ' ' ILE . 31.6 t -108.83 106.78 21.35 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 123.682 0.793 . . . . 0.0 109.881 179.871 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -93.39 141.92 27.91 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 173.45 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -79.24 118.56 21.29 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 173.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 74.1 t90 -84.5 105.77 15.57 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 -175.551 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -85.71 131.98 34.23 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 170.668 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -75.28 155.51 36.61 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.332 0.653 . . . . 0.0 110.834 177.509 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.16 0 CA-C-O 118.986 -0.897 . . . . 0.0 111.156 179.001 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 40.2 m . . . . . 0 N--CA 1.482 1.148 0 CA-C-O 120.359 0.123 . . . . 0.0 111.275 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 83.9 t60 -120.81 91.21 3.48 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.356 0.662 . . . . 0.0 109.624 175.41 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 59.9 mtm -146.62 76.36 11.85 Favored Pre-proline 0 N--CA 1.477 0.896 0 C-N-CA 124.953 1.301 . . . . 0.0 107.684 167.498 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -90.42 17.96 1.41 Allowed 'Trans proline' 0 C--N 1.381 2.257 0 C-N-CA 123.144 2.563 . . . . 0.0 112.035 178.599 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 9.8 t -139.17 155.26 47.96 Favored 'General case' 0 C--O 1.245 0.818 0 C-N-CA 124.599 1.159 . . . . 0.0 109.336 -178.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 25.9 t -78.75 100.37 7.07 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.108 178.221 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.442 ' HG3' ' HG2' ' A' ' 8' ' ' GLU . 8.9 pt-20 -47.6 -60.97 2.17 Favored 'General case' 0 CA--C 1.554 1.127 0 C-N-CA 125.404 1.481 . . . . 0.0 114.296 -172.046 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.442 ' HG2' ' HG3' ' A' ' 7' ' ' GLU . 14.9 mm-40 -96.63 15.86 20.53 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 123.432 0.693 . . . . 0.0 110.318 -174.785 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 54.9 51.99 12.7 Favored 'General case' 0 C--N 1.353 0.742 0 CA-C-O 122.238 1.018 . . . . 0.0 109.15 -164.296 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.655 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 88.0 mt -71.71 145.83 48.58 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 113.568 -1.651 . . . . 0.0 109.716 175.827 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.613 ' SG ' ' HB2' ' A' ' 30' ' ' SER . 45.2 t -59.3 118.26 28.98 Favored Pre-proline 0 CA--C 1.548 0.899 0 CA-C-O 118.357 -0.83 . . . . 0.0 108.901 173.251 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_endo -60.55 -17.37 48.18 Favored 'Trans proline' 0 N--CA 1.507 2.3 0 C-N-CA 123.111 2.54 . . . . 0.0 112.848 -176.58 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 67.8 mt -86.53 -46.2 16.55 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.871 0 C-N-CA 124.925 1.29 . . . . 0.0 111.628 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 91.9 m -92.66 -38.39 11.88 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.253 0.621 . . . . 0.0 111.564 -170.357 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.431 ' O ' HD13 ' A' ' 10' ' ' LEU . 98.1 m-85 74.69 -44.64 0.56 Allowed 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 126.232 1.813 . . . . 0.0 112.976 179.56 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -76.76 -32.49 57.76 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.268 0.627 . . . . 0.0 112.667 -175.517 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 15.6 m-70 -112.64 153.28 45.06 Favored Pre-proline 0 N--CA 1.481 1.1 0 C-N-CA 123.875 0.87 . . . . 0.0 109.52 -175.475 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.655 ' HA ' ' HA ' ' A' ' 10' ' ' LEU . 64.6 Cg_endo -79.05 -170.89 1.1 Allowed 'Trans proline' 0 C--N 1.38 2.213 0 C-N-CA 123.124 2.549 . . . . 0.0 113.9 -174.395 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.494 HG21 ' HB3' ' A' ' 29' ' ' LYS . 97.4 mt -89.99 143.18 11.72 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 CA-C-N 114.792 -1.094 . . . . 0.0 109.968 176.841 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.6 m -142.29 13.42 2.0 Allowed 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.079 0.952 . . . . 0.0 110.841 179.698 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -155.78 136.26 13.24 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.711 0.805 . . . . 0.0 110.928 -175.588 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.7 p -122.02 126.99 75.2 Favored 'Isoleucine or valine' 0 C--O 1.24 0.564 0 C-N-CA 124.605 1.162 . . . . 0.0 108.45 172.329 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -92.98 88.65 6.22 Favored 'General case' 0 C--O 1.244 0.789 0 N-CA-C 108.133 -1.062 . . . . 0.0 108.133 -178.281 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -71.56 152.35 93.77 Favored Pre-proline 0 C--O 1.242 0.704 0 CA-C-N 114.035 -1.438 . . . . 0.0 111.863 -177.506 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_endo -92.48 28.9 15.83 Favored 'Cis proline' 0 C--N 1.375 1.955 0 C-N-CA 125.783 -0.507 . . . . 0.0 112.616 -9.43 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 53.6 t -77.24 -40.31 45.33 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.258 0.623 . . . . 0.0 111.551 -176.022 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 91.73 -6.34 79.79 Favored Glycine 0 C--N 1.343 0.942 0 CA-C-O 119.37 -0.683 . . . . 0.0 114.369 179.168 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.503 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . 13.5 m170 -64.95 135.51 55.75 Favored 'General case' 0 N--CA 1.481 1.084 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 167.127 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.494 ' HB3' HG21 ' A' ' 19' ' ' ILE . 86.5 mttt -136.09 151.24 49.61 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.391 0.676 . . . . 0.0 110.644 -171.126 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.613 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 92.7 p -161.9 -173.93 3.92 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.486 1.114 . . . . 0.0 108.389 172.272 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 15.8 p -75.06 145.95 41.92 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 174.308 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -67.56 -19.81 65.32 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 122.951 0.5 . . . . 0.0 111.957 -173.456 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.78 -39.53 85.21 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 123.744 0.818 . . . . 0.0 111.536 171.408 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.8 m -61.74 -49.02 78.08 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.608 0.763 . . . . 0.0 111.721 178.364 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.516 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 9.7 tp -72.14 -36.68 57.24 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 O-C-N 123.116 0.26 . . . . 0.0 111.101 -173.36 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -64.11 -38.66 91.87 Favored 'General case' 0 CA--C 1.549 0.937 0 CA-C-O 121.126 0.488 . . . . 0.0 109.843 177.611 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.508 ' O ' ' HG2' ' A' ' 40' ' ' MET . 45.9 tt0 -69.75 -27.98 65.4 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 123.961 0.905 . . . . 0.0 110.767 173.661 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 78.3 t60 -83.59 -26.57 29.9 Favored 'General case' 0 C--O 1.21 -1.007 0 C-N-CA 123.281 0.632 . . . . 0.0 111.292 -177.303 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.575 HD22 ' HG3' ' A' ' 43' ' ' LYS . 88.0 mt -69.01 -30.77 69.24 Favored 'General case' 0 N--CA 1.486 1.338 0 CA-C-N 118.314 0.506 . . . . 0.0 111.328 -177.479 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.508 ' HG2' ' O ' ' A' ' 37' ' ' GLN . 25.1 ptt? -68.28 -21.03 64.81 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 122.402 0.281 . . . . 0.0 110.53 173.871 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.47 ' ND2' HD22 ' A' ' 42' ' ' ASN . 6.6 t30 -88.3 -75.81 0.41 Allowed 'General case' 0 CA--C 1.558 1.279 0 C-N-CA 124.435 1.094 . . . . 0.0 109.412 175.34 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.47 HD22 ' ND2' ' A' ' 41' ' ' ASN . 48.4 m-80 -148.35 151.56 35.55 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 124.778 1.231 . . . . 0.0 109.673 178.162 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.575 ' HG3' HD22 ' A' ' 39' ' ' LEU . 13.5 mptt -90.63 62.04 5.03 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.592 0.757 . . . . 0.0 110.176 179.709 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -130.16 174.49 9.76 Favored 'General case' 0 N--CA 1.481 1.102 0 CA-C-O 121.423 0.63 . . . . 0.0 110.953 179.221 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.503 ' SG ' ' HB2' ' A' ' 28' ' ' HIS . 41.8 t -98.49 45.87 1.01 Allowed 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.63 1.172 . . . . 0.0 110.86 -172.45 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 57.39 -87.31 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 125.651 1.58 . . . . 0.0 113.031 172.092 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 73.0 m-85 -75.27 -37.34 60.97 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.923 1.289 . . . . 0.0 111.572 -165.288 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 13.8 p -110.12 -9.43 14.71 Favored 'General case' 0 N--CA 1.482 1.153 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.432 -172.372 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 99.0 mttt 60.57 30.55 19.83 Favored 'General case' 0 N--CA 1.492 1.626 0 C-N-CA 124.502 1.121 . . . . 0.0 113.74 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 74.4 m -65.97 127.64 32.89 Favored 'General case' 0 N--CA 1.481 1.117 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 169.358 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 9.0 m -59.57 123.19 16.07 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 109.611 -0.515 . . . . 0.0 109.611 176.79 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 36.4 mm -59.51 105.7 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.929 0 O-C-N 123.757 0.661 . . . . 0.0 110.725 -176.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 35.4 t -79.28 -46.08 23.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 175.474 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 30.0 p -160.24 138.78 10.31 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.171 0.588 . . . . 0.0 111.071 176.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.5 HG11 HG21 ' A' ' 35' ' ' ILE . 65.4 t -106.66 108.5 25.31 Favored 'Isoleucine or valine' 0 C--O 1.243 0.722 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 170.564 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -104.12 147.38 27.49 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 123.322 0.649 . . . . 0.0 109.798 178.657 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -69.46 96.8 0.93 Allowed 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 178.043 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 63.4 t90 -72.43 110.44 6.83 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 -178.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -80.32 143.72 33.37 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 115.006 -0.997 . . . . 0.0 109.348 173.267 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.89 3.34 33.61 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 124.014 0.925 . . . . 0.0 111.266 -179.737 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.22 0 CA-C-O 119.534 -0.592 . . . . 0.0 112.164 -176.564 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_